standard x-ray diffraction powder patterns

The Neoliberal ChallengeTo the reader:What is Neoliberalism?Dag Einar Thorsend.e.thorsen@stv.uio.noDepartment of Political ScienceUniversity of OsloWorking paperOctober 10, 2009This paper is a revised version of the article “Kva er nyliberalisme?” / “What isNeoliberalism?” – which was written and published in Norwegian in 2007. The Englishversion has since been circulated as a working paper in several different versions. It is myintention to use this paper for two different purposes. Firstly, it will become part of mydoctoral thesis, which is scheduled for completion and submission in July 2010. Secondly, Iplan to publish it as a separate article in English. The text contains a few cross-references tothe rest of my forthcoming doctoral thesis. These cross-references should be ignored at thisoccasion. All kinds of comments are welcome at this still early stage.Table of contents:INTRODUCTION ................................................................................................................................ 2LIBERALISM ....................................................................................................................................... 4NEOLIBERALISM: CONCEPTUAL HISTORY AND DEFINITIONS ........................................ 8NEOLIBERALISM – IS IT A USEFUL CONCEPT? .................................................................... 17DO WE LIVE IN ‘THE AGE OF NEOLIBERALISM’? ............................................................... 19BIBLIOGRAPHY ............................................................................................................................... 21

NATIONAL BUREAU OF STANDARDSThe National Bureau of Standards 1 was established by an act of Congress March 3,1901. The Bureau's overall goal is to strengthen and advance the Nation's science andtechnology and facilitate their effective application for public benefit. To this end, theBureau conducts research and provides: (1) a basis for the Nation's physical measurement system, (2) scientific and technological services for industry and government, (3)a technical basis for equity in trade, and (4) technical services to promote public safety.The Bureau consists of the Institute for Basic Standards, the Institute for MaterialsResearch, the Institute for Applied Technology, the Center for Computer Sciences andTechnology, and the Office for Information Programs.THE INSTITUTE FOR BASIC STANDARDS provides the central basis within theUnited States of a complete and consistent system of physical measurement; coordinatesthat system with measurement systems of other nations; and furnishes essential servicesleading to accurate and uniform physical measurements throughout the Nation's scientific community, industry, and commerce. The Institute consists of a Center for Radiation Research, an Office of Measurement Services and the following divisions:Applied Mathematics Electricity Heat Mechanics Optical Physics LinacRadiation2 Nuclear Radiation 2 Applied Radiation2 Quantum Electronics3Electromagnetics 3 Time and Frequency 3 Laboratory Astrophysics3 Cryogenics3 .THE INSTITUTE FOR MATERIALS RESEARCH conducts materials research leading to improved methods of measurement, standards, and data on the properties ofwell-characterized materials needed by industry, commerce, educational institutions, andGovernment; provides advisory and research services to other Government agencies;and develops, produces, and distributes standard reference materials. The Institute consists of the Office of Standard Reference Materials and the following divisions:Analytical Chemistry Polymers Metallurgy Inorganic Materials ReactorRadiation Physical Chemistry.THE INSmTUTE FOR APPLIED TECHNOLOGY provides technical services to promote the use of available technology and to facilitate technological innovation in industry and Government; cooperates with public and private organizations leading to thedevelopment of technological standards (including mandatory safety standards), codesand methods of test; and provides technical advice and services to Government agenciesupon request. The Institute also monitors NBS engineering standards activities andprovides liaison between NBS and national and international engineering standardsbodies. The Institute consists of the following technical divisions and offices:Engineering Standards Services Weights and Measures Flammable FabricsInvention and Innovation Vehicle Systems Research Product EvaluationTechnology Building Research Electronic Technology Technical AnalysisMeasurement Engineering.THE CENTER FOR COMPUTER SCIENCES AND TECHNOLOGY conducts research and provides technical services designed to aid Government agencies in improving cost effectiveness in the conduct of their programs through the selection, acquisition,and effective utilization of automatic data processing equipment; and serves as the principal focus within the executive branch for the development of Federal standards forautomatic data processing equipment, techniques, and computer languages. The Centerconsists of the following offices and divisions:Information Processing Standards Computer Information Computer ServicesSystems Development Information Processing Technology.THE OFFICE FOR INFORMATION PROGRAMS promotes optimum disseminationand accessibility of scientific information generated within NBS and other agencies ofthe Federal Government; promotes the development of the National Standard ReferenceData System and a system of information analysis centers dealing with the broaderaspects of the National Measurement System; provides appropriate services to ensurethat the NBS staff has optimum accessibility to the scientific information of the world,and directs the public information activities of the Bureau. The Office consists of thefollowing organizational units:Office of Standard Reference Data Office of Technical Information andPublications Library Office of Public Information Office of InternationalRelations.1 Headquarters and Laboratories at Gaithersburg, Maryland, unless otherwise noted; mailing address Washington, D.C. 20234.* Part of the Center for Radiation Research.* Located at Boulder, Colorado 80302.

UNITED STATES DEPARTMENT OF COMMERCE Maurice H. Stans, SecretaryNATIONAL BUREAU OF STANDARDS Lewis M. Bran8comb, DirectorStandard X-ray DiffractionPowder PatternsSection 9 Data for 63 SubstancesHoward E. Swanson, Howard F. McMurdie, Marlene C. MorrisEloise H. Evans, and Boris ParetzkinAssisted by Johan H. DeGroot and Simon J. CarmelInstitute for Materials ResearchNational Bureau of StandardsWashington, D.C. 20234*X ML \\ _National Bureau of Standards Monograph 25 Section 9Nat. Bur. Stand. (U.S.), Monogr. 25 Section 9, 128 pages (Dec. 1971)CODEN: NBSMAIssued December 1971For sale by the Superintendent of Documents, U.S. Government Printing Office, Washington, D.C. 20402(Order by SD Catalog No. C13.44;25/Sec. 9), Price $1.25.

Library of Congress Catalog Card Number: 53-61386

CONTENTSPageIntroduction ........................................ 1Reference intensity values ........................... 4Experimental patterns:Ammonium Aluminum Fluoride, (NH 4 ) 3 AIF 6 ........... 5Ammonium Aluminum Selenate Hydrate,NH 4 AI(Se0 4 ) 2 -12H 20............................. 6Ammonium Copper Chloride Hydrate,(NH 4 ) 2 CuCI 4 '2H 20............................... 8Ammonium Iron Fluoride, (NH 4 ) 3 FeF 6 ................ 9Barium Calcium Tungsten Oxide,Ba 2 CaW0 6 ...................................... 10Barium Chloride, BaCI 2 , (orthorhombic)............... 11Barium Chloride, BaCI 2 , (cubic)..................... 13Barium Titanium Silicate (fresnoite),Ba 2 TiSi 2 O g ..................................... 14Cadmium Iron Oxide, CdFe 2 0 4 ...................... 16Calcium Titanium Oxide (perovskite),CaTi0 3 ......................................... 17Calcium Tungsten Oxide, Ca 3 W0 6 ................... 19Cobalt Chromium Oxide, CoCr 2 0 4 .................... 21Cobalt Iron Oxide, CoFe 2 0 4......................... 22Lithium Sodium Aluminum Fluoride,cryolithionite, Li 3 Na 3 AI 2 F 12 ...................... 23Magnesium Aluminum Oxide (spinel),MgAI 2 0 4 (revised)............................... 25Magnesium Sulfite Hydrate,MgS03 -6H 20..................................... 26Manganese Chloride Hydrate, MnCI 2 '4H 2 0 ............ 28Manganese Cobalt Oxide, MnCo 2 0 4 .................. 30Potassium Aluminum Sulfate, KAI(S0 4 ) 2 .............. 31Potassium Barium Nickel Nitrite,K 2 BaNi(N0 2 ) 6................................... 32Potassium Calcium Nickel Nitrite,K 2 CaNi(N0 2 ) 6 .................................. 33Potassium Copper Chloride Hydrate(mitscherlichite), K 2 CuCI 4 '2H 20................... 34Potassium iron Cyanide, K 3 Fe(CN) 6 ................. 35Potassium Iron Fluoride, K 3 FeF 6 .................... 37Potassium Nitrite, KN0 2 ........................... 38Potassium Oxalate Hydrate, K 2 C 2 0 4 'H 20............. 39Potassium Selenate, K 2 Se0 4 ........................ 41Potassium Sodium Aluminum Fluoride(elpasolite), K 2 NaAIF 6 ........................... 43Rubidium Selenate, Rb 2 Se0 4 ................... ..... 44Silver Cyanide, AgCN.............................. 46Silver Oxalate, Ag«C 2 0 4 ........................... 47Sodium Chromium Oxiae, Na 2 Cr0 4 ................... 48PageSodium Chromium Oxide Hydrate,Na 2 Cr0 4 '4H 2 050Sodium Hydrogen Sulfate Hydrate,NaHS0 4 -H 20.................................... 52Sodium Iron Fluoride, Na 3 FeF 6 ...................... 54Sodium Selenate, Na 2Se0 4 .......................... 55Tin Sulfide (berndtite), beta, SnS 2 ................... 57Vanadium, V...................................... 58Zinc Chromium Oxide, ZnCr 2 0 4 ..................... 59Zinc Iron Oxide (franklinite), ZnFe 2 0 4 ............... 60Calculated patterns:Aluminum Chloride, AIC1 3 .......................... 61Barium Oxide, BaO ................................ 63Beryllium, alpha, Be............................... 64Beryllium Lanthanum Oxide, Be 2 La 2 0 5 ............... 65Calcium, Ca ...................................... 68Cesium Beryllium Fluoride, CsBeF 3 ................. 69Hydrogen Berate, beta, HB0 2 ....................... 71Magnesium Phosphate, alpha, Mg p o ............... 73Manganese Vanadium Oxide, Mn 2 V 2 0 7 ................ 75Methanesulfonanilide, C 6 H 5 -NH-S0 2 CH 3 ............ 78Nickel Chloride, NiCI 2 ............................. 81Nickel Phosphide, Ni 12 P 5 .......................... 83Phosphorus Oxide (stable form I),P 2 0 5 , (orthorhombic)............................. 86Phosphorus Oxide (stable form II),P 2 0 5 , (orthorhombic)............................. 88Phosphorus Oxide (metastable form),P 4 0 10 , (rhombohedral)............................ 91Potassium Hydrogen Diformate,KH(HCOO) 2 ..................................... 93Potassium Oxalate Perhydrate,K 2 C 2 0 4 -H 2 0 2 , 96Potassium Sulfate, K 2 S 2 0 7 ......................... 99Rubidium Oxalate Perhydrate,Rb 2 C 2 0 4 'H 2 0 2 , 102Sodium, Na ....................................... 105Sodium Calcium Carbonate Hydrate,pirssonite, Na 2 Ca(CQ 3 ) 2 '2H 2 0 .................... 106Sodium Molybdenum Oxide, Na 2 Mo 2 0 7 ................ 110Trimethylammomum Chloride,(CH 3 ) 3NHCI..................................... 113Cumulative index to Circular 539,Volumes 1 through 10, and Monagraph 25,Sections 1 through 9 .............................. 115Cumulative mineral index............................. 125iii

ErrataMonograph 25Section 8, pg. 12; N should be 1.486PSection 8, pgs. 36, 37, 46, 47, 58, 76. Data in the table headingsshould read: a=3.16516 and A=l.54056Section 8, pg. 68; N should be 1.6217 and N should be 1.6330 andN =1.6435aas given by Tutton pSection 8, pg. 129; both tables are for hexagonal NaN 3 and shouldappear on page 130.Section 8, pgs. 130-131; both tables are for monoclinic NaN 3 andshould appear on page 129STANDARD X-RAY DIFFRACTION POWDER PATTERNSNBS Monograph 25, Sections 1, 2, 3 and NBS Circular 539, Volumes 1thru 10 may be obtained from Mr. Howard E. Swanson, Room A221, MaterialsBuilding, National Bureau of Standards.The following five volumes in this series are available from theSuperintendent of Documents, U.S. Government Printing Office, Washington,D.C., 20402, as follows:NBS Monograph 25, Section 4, 55 cents; Section 5, 55 cents; Section 6,60 cents; Section 7, $1.50; Section 8, $1.50.(Order by SD Catalog No. C 13.44:25/Sec.—)Send orders with remittance for the above five Monographs to Superintendentof Documents, U.S. Government Printing Office, Washington, D.C., 20402.Remittance from foreign countries should include an additional one-fourth ofthe purchase price for postage.Those wishing to be notified of future issues should send mailing addressto the Government Printing Office.

STANDARD X-RAY DIFFRACTION POWDER PATTERNSHoward E. Swanson, Howard F. McMurdie, 1 Marlene C. Morris, 2Eloise H. Evans, 2 and Boris Paretzkin 2Assisted by Johan H. deGroot2 and Simon J. C arm elStandard x-ray diffraction patterns are presented for 63 substances. Forty of these patterns represent experimental data and 23 arecalculated. The experimental x-ray powder diffraction patterns were obtained with an x-ray diffractometer. All d-values were assignedMiller indices determined by comparison with computer interplanar spacings consistent with space group extinctions. The densitiesand lattice constants were calculated, and the refractive indices were measured whenever possible. The calculated x-ray powderdiffraction patterns were computed from published crystal structure data. Both peak height and integrated intensities are reported forthe calculated patterns.Key words: Crystal structure; integrated intensities; lattice constants; peak intensities; powder patterns; reference intensities;standard; x-ray diffraction.INTRODUCTIONThe Powder Diffraction File is a compilation of diffractionpatterns, gathered from many sources, produced, and publishedby the Joint Committee on Powder Diffraction Standards. 3 TheFile is used for identification of crystalline materials bymatching d-spacings and diffraction intensity measurements.Under the partial sponsorship of the Joint Committee, ourprogram at the National Bureau of Standards contributes newdata to this File. Our work also aids in the evaluation andrevision of published x-ray data and in the development ofdiffraction techniques. This report presents information for 63compounds (40 experimental and 23 calculated patterns), andis the nineteenth of the series of "Standard X-ray DiffractionPowder Patterns 11 .4EXPERIMENTAL POWDER PATTERNSSample. The samples used to make NBS patterns wereobtained from a variety of sources or were prepared in smallquantities in our laboratory. Appropriate annealing, recrystallizing,or heating in hydro! her ma I bombs improved the qualityof most of the patterns. A check of phase purity was usuallyprovided by indexing the x-ray pattern.lf2 Consultant and Research Associates, respectively, of the Joint Committee onPowder Diffraction Standards Associateship at the National Bureau of Standards.Joint Committee on Powder Diffraction Standards, 1601 Park Lane ,Swarthmore,Pa. 19081. This Pennsylvania non-profit corporation functions in cooperationwith the American Society for Testing and Materials, the American CrystallographicAssociation, The Institute of Physics, the National Association ofCorrosion Engineers, the American Ceramic Society, the Mmeralogical Societyof America, and the Canadian Mmeralogical Society.See previous page for listing of other published volumes.Optical data, color. A microscopic inspection forphase purity was also made on the non-opaque materials duringthe refractive index determination. The latter was done bygrain-immersion methods in white light, with oils standardizedin sodium light, in the refractive index range 1.40 to 2.1.[Hartshorne and Stuart, I960].The names of the sample colors were selected from theISCC-NBS Centroid Color Charts.Structure, lattice constants. The space groupsare listed with short Hermann-Mauguin symbols as well as thespace group numbers given in the International Tables forX-ray Crystallography Vol. I [1952].Orthorhombic cell dimensions were arranged according tothe Dana convention b>a>c [Palache et al., 1944],A computer program [Evans et aL, 1963] assigned hkfi'sand refined the lattice constants. Cell refinement was basedonly upon 2o values which could De indexed without ambiguity. In indexing cubic patterns, multiple hk£'s were notreported; instead, we chose the single appropriate indexhaving the largest h. The number of significant figures reportedfor d-values varied with the symmetry and crystallinity of eachsample. Unit cell constants and their standard errors werebased on least-squares refinement of the variance-covariancematrix derived from the unweighted M residuals.Densities. These were calculated from the NBS latticeconstants, the Avogadro number (6.06252 x 10 23), and atomicweights based on carbon 12 [International Union, 1961].Interpianar spacings. For spacing determinations, ashallow holder was packed with a sample mixed with aninternal standard (approximately 5 wt. percent tungstenpowder). When tungsten lines were found to interfere, approximately 25 wt. percent powdered silver was used in place oftungsten. If the internal standard correction varied along thelength of the pattern, linear interpolations were used. To avoidaberrations at the very top of the peak, the reading of 2e wastaken at a position about 20 percent of the way down from the

top, and in the center of the peak width. The internal standardcorrection appropriate to each region was then applied to themeasured value of 20. We have reported all data as Kal peaksDecause the internal standard corrections for all regions wereestablished in terms of the Kttl wavelength. The latticeconstants used for the internal standards at 25 C are given inthe table below. The following angles for high purity (four 9's)tungsten, silver, and cadmium oxide were computed using celldimensions uncorrected for index of refraction.All of our spacing determinations were recorded at25 1 C on a diffractometer equipped with a curved lithiumfluoride crystal monochromator located between the sampleand the Geiger counter. Copper radiation was used and thewavelength K

Ammonium Aluminum Selenate Hydrate, NH 4AI(Se0 4) 2 '12H 20SampleThe sample was made by slow evaporationof a 1:1 aqueous solution of (NELt ) sand Alg (SeO 4 ) 3 at room temperature.ColorColorlessOptical dataIsotropic, N=1.486d (A)7.176.225.565.084.410Internal standard W, a = 3.16516 ACuKcij A = 1.54056 A; temp. 25 °C/2025703090hkl1112002102112202v (°)12.3314.2215.9317.4420.13StructureCubic, Pa3 (205),Z=4, NH4 A1 (SeO 4 ) 2 *12HsOis isostructural with other a-alums suchas KA1(SO 4 ) 2 -12HsO [Haussiihl, 1961],4.153.753.593.4523.32780203610022131122232032121.4123.7124.8025.7926.77NBS, sample at 25 °CLattice constants0a(A)12.4432±.00043.1103.0172.9312.8562.7832.7142.6552.5402.4872.4402040225101916322040041041133142042133242243043128.6829.5830.4731.2932.1432.9833.7335.3136.0936.81Density(calculated) 1.886 g/cm 3 at 25° C.Reference intensity2.3112.2722.1992.1672.105214121025052144052253138.9439.6341.0041.6442.94' corundum ~ J- • OReferencesHaussiihl, S. (1961). Z. Krist* 116, 371.2.0742.0462.0191.9671.9431.9191.8981.8771.8561.83581211421014241160061061162062154153362263063143.6144.2444.8646.1146.7047.3347.8948.4749.0549.651.760Io7431.7251.7101.6935426454371164027072151.9252.4653.0553.5654.11

Ammonium Copper Chloride Hydrate, (NH 4) 2CuCI 4 '2H 20SampleThe sample was prepared by slow evaporation at room temperature of a 2:1 aqueous solution of NH4 Cl and CuCl 2 -Major impurities0.001-0.01% each: Al and Mg.ColorBrilliant greenish blued(A)5.495.373.9823.3953.200oInternal standard W, a = 3.16516 ACuK fll A = 1.54056 A; temp. 25 °C/1005052025hkl10111000221011220C)16.1216.4822.3126.2327.86Optical dataUniaxial (-), NQ=1.668, Ne=1.640StructureTetragonal, P4 2 /mnm (136), Z=2 [Hendricksand Dickinson, 1927]. The structure was refined by Chrobak [1934]3.1242.7452.6842.5842.5062.4112.4082.2282.0932.058307090171288209621120222021210330131022221331228.5532.5933.3534.6835.8037.2637.3840.4643.1843.97Lattice constants0a (A)0c(A)2.0361.9921.8991.8671.8431220149832100440011441044.4545.5047.8548.7449.42NBS, sample at 25 °C7.594+ .0017.967±.0011.7931.7901.7181.7131.6728758841133021440241250.8750.9953.2753.4354.87Density(calculated) 2.005 g/cm 3 at 25° C.1.6501.6321.5991.5604518532333222410555.6756.3257.6059.18Reference intensityAdditional patterns1. PDF card 1-211 [Hanawalt et al.,1938]2. Greenberg and Walden [1940]3. Chrobak [1934]ReferencesChrobak, L. (1934). 2. Krist. 88, 35.Greenberg, A.L. and G.H. Walden Jr. (1940)Jour. Chem. Phys. 8, 645.Hanawalt, J.D., H.W. Rinn, and L.K. Frevel(1938). Ind. Eng. Chem. Anal.Ed. 10, 457.Hendricks, S.B. and R.G. Dickinson (1927).J. Am. Chem. Soc. 49, 2149.

Ammonium Iron FUioride, (NH 4) 3 FeF 6SampleThe sample was prepared by adding an a-gueous solution of FeCla to a solutionof NH*F in HF.ColorColorlessOptical dataIs ot ropic, N=1.440StructureCubic, F23 (196) or F43m (216), Z=4,structure determined by Pauling [1924].Except for the hydrogen positions, thestructure also satisfies the conditionsfor Fm3m (225). The compound is isostructuralwith (NH^JaAlFe and many other hexafluorides.Lattice constantsNBS, sample at 25 °C —————————a(A)9.1066±.0003d(A)5.254.5583.2212.7442.6292.2772.0892.0381.8581.7531.60991.53941.51791.43991.38941.37321 . 3 1441.27561.26271.21680Internal standard W, a = 3.16516 A ,CuKaj * = 1.54056 A; temp. 25 °C7100555084251912127844211213hkl111200220311222400331420422511440531600620533622444711640642&

Barium Calcium Tungsten Oxide, Ba 2 CaW0 6SampleThe sample was prepared by heating CaCOaand HsWO4 -H 2 O at 700 °C, then addingBaCO3 and heating at 1200 °C for half anhour.d (A)oInternal standard Ag, a = 4.08641 ACuKa a A= 1.54056 A; temp. 25 °CIhklze(°)ColorYellow grayStructureCubic, Fm3m (225), Z=4, isostructuralwith (NH4 ) 3 FeF6 [Steward and Rooksby,1951]. The structure of (NH4 )3FeF6 wasdetermined by Pauling [1924].4.854.192.972.5282.4212.0961.9231.8751.7111.614251100104304140511120022031122240033142042251118.2921.1730.1135.4837.1143.1347.2248.5053.5157.03Lattice constantsNBS , sample at 25 °C ——— - ——————Density(calculated) 6.701 g/cm 3 at 25° C.Reference intensityI/I , - 8.8' corundum —a(A)8.384±.001Additional patterns1. PDF card 6-400 [Steward and Rooksby,1951]2. PDF card 20-210 [Chang et al.,1966]ReferencesChang, L.L.Y., M.G.Scroger, and B.Phillips(1966). J. Am. Ceram. Soc. 49, 385.Pauling, L. (1924). J.Am.Chem.Soc.46,2738.Steward, E.G.,andH.P. Rooksby (1951).ActaCryst. 4, 503.1.4821.4171.32561.27831.26361.21001.17391.12051.09151.04811.0245.9882.9682.9373.9204.8939.8789.8557.8426.8222.81061541521521422

Barium Chloride, BaCL, (orthorhombtc)SampleThe sample was obtained from Fisher Scientific Co. Fair Lawn, N. J. , and washeated overnight at 875 °C.Major impurities0.001-0.01% each: Sr0.01 -0.1 % each: Cad (A)4.2254.0463.9353.7233.0720Internal standard W, a = 3.16516 ACuKaj A = 1.54056 A; temp. 25 °C/4585457020hklOil1202001111212*021.0121.9522.5823.8829.04ColorColorlessOptical dataBiaxial, Na=1.730, Ng=l,736, N y =1.741,2V is very large.StructureOrthorhombic, Pnam (62), Z=4, isostructuralwith PbCl2 [Doll and Klemm, 1939] .The structure was refined by Brackett etal. [1963] and Sahl [1963].3.0283.0202.9162.8792.6172.5462.5292.4822.4562.3662.3552.2922.2312.1782.0422.037^

Barium Chloride, BaCL, (orthorhombic) - continuedPolymorphismBaCla is stable in a cubic (fluorite)form above 925 °C. A monoclinic form ismentioned but no stability range defined[Vainshtein, 1948].d (A) 11.5134 L - 561148i8 \4241229262260351213033133531360313233,170600062,451361162171442601,620541611262,333271413153004362,551253640,43312463.7263,8664.3366.2367.4269.6169.7170.2870.9771.9372.1372.9373.2474.1474.4575.1175.2575.8776.6877.5378.2880.2081.2582.2783.5684.4685.4412

Barium Chloride, BaCI 2 , (cubic)SampleThe sample was prepared by heating^HeO at 70 °C overnight in vacuum.This is the method described by Brackettet al. [1963]. Cubic BaCla is stable a-bove 925 °C [Brackett et al. [1963]. It-persists at room temperature for severalhours however, before reverting to theorthorhombic form.Major impurities0.001-0.01% each: Sr0.01 -0.1 % each: Cad(A)4.233.662.5862.2052.110oInternal standard Ag, a = 4.08641 A1.82741.67691.63481.49211.4071CuKaj A= 1.54056 A; temp. 25 °C7709100506162594019hkl1112002203112224003314204225112Bf)20.9924.3034.6640.9042.8349.8654.6956.2262.1666.38ColorColorless1.29241.2357111644053173.1777.12StructureCubic, Fm3m (225), Z=4, isostructuralwith CaF2 [Vainshtein, 1948].Lattice constantsAdditional patterns1. Solans-Huguet and Font-Altaba [1968*]*intensities based on CaFa2. PDF card 1-948 is mislabeled "highform11 but is essentially orthorhombicNBS, sample at 25°CDensity(calculated) 3.539 g/cm 3 at 25° C.o7.311±.001PolymorphismBelow 925 °C the stable form oforthorhombic [Gemsky, 1913].ReferencesBrackett, E. B., T. E. Brackett and R. L.Sass (1963). J. Phys. Chem. 67, 2132.Gemsky, H. (1913). Neues Jahr. Mineral.Geol. 36, 513.Solans-Huguet, J.and M. Font-Altaba(1968) 0Anales De Quimica 64, 425.Vainshtein, B.K. (1948). Dokl. Akad. NaukSSSR 60, 1169.is13

Barium Titanium Silicate (fresnoite), Ba 2TiSi 20 8SampleThe sample was prepared at NBS by C. R.Robbins [1970] .0Internal standard Ag, a = 4.08641 ACuKai A= 1.54056 A; temp. 25 °CColorColorlessOptical dataUniaxial(-) N -1.775, N =1.765, [Robbins,1970] °d(A)6.035.224.2673.9473.816/51481220hkl11000120011121020(*)14.6716.9820.8022.5123.29StructureTetragonal, P4bm (100), Z=2 [Masse,Grenier and Durif, 1967] and [Moore andLouisnathan, 1967]3.3013.0773.0172.6972.60745100102520201211220310221,00226.9928.9929.5833.1934.37Lattice constantsNBS, sample at 25 °C ————a(A)8.5291±.0004c(A)5.2110±.00032.3952.3642.2232.1512.1332.0692.0091.9711.9221.9078262041610615631132020221240041033022241142037.5238.0340.5441.9742.3443.7245.0846.0047.2547.65Density(calculated) 4.439 g/cm 3 at 25° C.Reference intensityI/I . - 4.2' corundum ~~1.8741.7521.7381.6681.6501.6201.6091.59131.58041.5387202312951111231232200311340241220333221342248.5552.1752.6355.0055.6556.7857.2057.9058.3460.08Additional patterns1. PDF card 11-150* [Rase and Roy, 1955]2. PDF card 18-197 [Alfors et al., 1965]* given as BaTiSiO 5 however, accordingto Robbins [1970], 11-150 is the sameas fresnoite.1.51541.50741.46241.42181.40811.40191.37181.35361.33051.31446533322253521440530600531,512610601611,52241333361.1061.4663.5765.6166.3366.6668 0 3269.3770.7571.75u

Barium Titanium Silicate (fresnoite), Ba 2TiSi 20 8 - continuedd(A)7fcfeZ26>(*)1.30501.30301.29071.27541.24751.24561.23271.20491.19811.19591.18631.17291.17031.15321.1428444333222124512621,442004541532602204214513622224542314523641721,63272.3572.4873.2874.3176.2676.4077.3479.4880.0280.2080.9882.1082.3283.8284.76ReferencesAlfors, J.T. M.C. Stinson, R. A. Ma thews,and A Pabst(1965). Am. Mineralogist 50,314.Masse,R , J.C. Grenier,and A. Durif(1967).Bull. Soc. Franc. Mineral.Grist. 90, 20.Moore,P.B. and J. Louisnathan (1967). Science 156, 1361.Rase,D.E. and R. Roy (1955). J. Am. Ceram.Soc. 38, 389.Robbins, C. R. (1970). J. Res. Natl. Bur.Std. A 74A, No. 2, 229.1.11911.11171.10231.09981.09342122253340441460333486.9987.7188.6688.9189.581.07561.06881.06511.05701 . 044413231424651,72262354380191.4792.2292.6493.5695.041.04221.03681.03421.02711.01251321100574182011520595.3095.9696.2897.1799.071.0060252499.9315

Cadmium Iron Oxide, CdFe 20 4SampleThe sample was prepared by co-precipitation of the hydroxides by addition ofNaOH to a solution of FeCl3 and CdCl2 .The product was then washed, heated at500 °C for three days, ground,and heatedfor two minutes at 850 °C.ColorStrong brownd(A)3.0752.6232.5142.1751.997Internal standard W, a = 3.16516 ACuKGi A = 1.54056 A; temp. 25 °C/60100853hkl2203112224003312&C)29.0134.1535.6941.4845.38Optical dataIsotropic, N1931]Structure= 2.39 [Roberts and Merwin,Cubic, Fd3M (227), Z = 8, spinel type[Posnjak, 1930].1.7761.6741.5381.3761.3271.31171.21821.16241.13231.08742035357931813442251144062053362271164273180051.4154.7860.1268.1070.9671.9278.4583.0185.7390.20Lattice constantsa(A)1.06291.02521 . 0044.9980.95501462

Calcium Titanium Oxide (perovskite), CaTi0 3SampleThe sample was prepared by Coughanour etal. [1955] by mixing equimolar amountsof CaO and TiO2 and pelletizing at 5000lb/in2 . The pellets were then heated to1000 to 1200 °C for four hours in an oxidizing atmosphere.ColorYellowish whiteOptical dataAlmost isotropic, N = 2.4StructureOrthorhombic, Pnma (62), Z=4, distortedperovskite [Kay and Bailey, 1957] .NBS , sample-»+- *>C °p —Lattice constantsa(A)5 4.4-05 j * **** \j j±.0002b(A)7.6436±.0005Density(calculated) 4.036 g/cm 3 at 25° C.Reference intensityI/I . - 2.6corundum ~C(A)5 *3 D 1 O±.0003d(A)3.8243.4232.7192.7012.5632.4282.4132.3132.3032.2172.2012.1212.0502.0401.9111.8601.8561.7571.7521.7461.7191.7101.7031.6761.6631.5671.5631.5571.5291.49780Internal standard W, a = 3.16516 ACuKaj A = 1.54056 A; temp. 25 °C/143401001124764221502311123231141625

Calcium Titanium Oxide (perovskite), CaTiCL - continuedd(A)1.29131.27801.25781.23561.21381.20881.19951.19421.19131.1622I11

Calcium Tungsten Oxide, Ca 3W0 6SampleThe sample was prepared by a solid statereaction of CaCO 3 and HWO 3 when heatedat 1000 °C for 24 hours.ColorColorlessOptical dataLow birefringence, N ^ 2.00StructureMonoclinic, P2 l /n (14), Z=2, by analogyof the powder pattern with that ofNa 3 FeF 6 . Steward and Rooksby [1951] considered that the structure of Ca 3 WO 6 wassimilar to (NH 4 )sPeF 6 but departed considerably from cubic symmetry, and theysuggested that the atomic arrangementmight be identical to that of Na 3 AlF 6 .d(A)4.7014.5624.0083.5892.9052.8352.7762.5032.4512.4252.4032.3932.3502.2832.2780Internal standard W, a = 3.16516 ACuKdj A = 1.54056 A; temp. 25 °C76045654301003021671620424hklOil101,101110,002111,111020112200210121,1210131032110222022022t:(«)18.8619.4422.1624.7930.7531.5332.2235.8536.6437.0437.3937.5638.2639.4339.53a(A)Lattice constantsb(A)C(A)PC)2.2202.1642.0052.0021.9644330302113122,12222000402340.6041.7145.1845.2646.19NBS,sampleat 25°C5.547±.0015.808±.0018.002±.00190.15±.011.9451.8821.8531.8271.802348126221,221031123130,213301,30146.6548.3249.1349.8750.62Density(calculated) 5.154 g/cm 3 at 25° C.Reference intensityI/I ,-corundum ~~ 9 . .71.7911.7621.7211.6621.6481.6241.6201.6141.6111.5661742181481320192222,114310311,311132,13202420420431231203350.9451.8453.1955.2155.7556.6256.7857.0257.1158.911.5581.5431.5381.5311.52284443231,23101510532130359.2859.9060.1160.4060.8219

Calcium Tungsten Oxide, Ca 3 W0 6 - continuedd(A)1,5181.5071.4521.4171.415/223810hkl303133322,040224224*>(°)61.0061.4764.0965.8565.96Additional patterns1. PDF card 20-244 [Chang et al. f 1966]2. Baglio, J.A C and S. Natansohn1.3861.3841.3651.3601.3491.3371.3311.3241.3211.3126666824222400141,141233,042125410,13433041131431440267.5167.6368.7168.9769.6570.3570.7471.1371.3671.90ReferencesChang, L.L.Y., M.G. Scroger, and B. Phillips (1966). J. Am. Ceram. Soc. 49, 385.Steward, E. G. and H. P. Rooksby (1951).Acta Cryst. 4, 503.Baglio, J.A. and S. Natansohn (1969). J.Appl. Cryst. 2, 252.1.3091.26621040211672.1074.9320

Cobalt Chromium Oxide, CoCr 20 4SampleThe sample was made by heating a mixtureof CoO and Cr2 O 3 overnight at 900 °C.,grinding, and reheating for 17 hours at1200 °C.d(A)0Internal standard W, a = 3.16516 ACuKd! * = 1.54056 A; temp. 25 °C7hkl20 (°)ColorDark bluish greenStructureCubic, Fd3m (227), Z=8, spinel[Natta and Passerini, 1929] .type4.822.9472.5122.4052.0841.7001.60271.47211.40811.317114351008251235452411122031122240042251144053162018.4130.3035.7237.3643.3953.9057.4563.1066.3371.58Lattice constantsNBS, sample at 25 °C — - -a(A)8 *3 OQQ±.00021,27021.25561.20231.16641.11311.08441.0409.9818.9618.955410531514427453362244471164273180082275166274.6675.6879.6882.6587.5890.5295.46103.36106.42107.46Density(calculated) 5.215 g/cm 3 at 25° C.Reference intensityI/I _ 1.8' corundum ~.9313.9141.8880.8732.8502.8168.805341271331084091166493184410-2-0951111.61114 . 84120.33123.81129.92141.12146.08Additional patterns1. PDF card 1-1122 [New Jersey Zinc Co.,Palmerton, Pa.]ReferencesNatta, G., and L. Passerini (1929). Gazz,Chim. Ital. 59, 280.21

Cobalt Iron Oxide, CoFe 2 0 4SampleThe sample was prepared by adding Co(OH)2dissolved in NaOH to a FeCl 3 solutionacidified with HCl. This mixture washeated to 80 °C while CoFe^O^ was precipitated by adding NaOH to a pH of 10.The precipitate was heated to 950 °C inair for 40 hours.ColorBlackStructureCubic, Fd3m (227), Z=8, spinel[Natta and Passerini, 1929].Lattice constantsNBS, sample at 25 °C —————————Density(calculated) 5.304 g/cm 3 at 25° C.Reference intensityI/I . _ 2.7corundum ~a(A)8.3919±.0001typed(A)4.8472.9682.5312.4242.0991.9261.7131.6151.4831.4191.32731.27981.26521.21141.17491.12141.09251.0490.9891.9690.9627.9382.9213.8946.8797.8564.8434.8229.8112.80750Internal standard W, a = 3.16516 ACuKd! A = L54056 A; temp. 25 °CI10301008201103040 -3494224252844126141382hkl11122031122240033142271144053162053362244455164273180082275166284091166493184493310-2-095110-2-22*(°)18.2930.0835.4437.0643.0647.1653.4556.9762.5765.7570.9574.0175.0178.9781.9386.7789,6794.50102.30105.29106.29110.38113.46118.87122.24128.16131.93138.80143.43145.07Additional patterns1. PDF card 1-1121, incorrectly labelledCoPe s O4 [New Jersey Zinc Co., Palmerton,Pa.]ReferencesNatta, G., and L. PasseriniChim. Ital. 59, 280.(1929). Gazz,22

Lithium Sodium Aluminum Fluoride, cryolithionite, Li 3 Na 3 AI 2F 12SampleA natural mineral from Ivigtut, Greenland (National Museum #94311) was used.It contained a few percent of NasAlF6and these lines were disregarded. An a-nalysis by Menzer [1930] of materialfrom this locality indicated that thecryolithionite had total impurities ofless than 0.3 weight percent, and thatthe Na to Li ratio was 3:2.82.Major impurities0.001-0.01% each: Ag, Ba, Ca, Cu, Ni, Pb,Si, and Ti.0.01 -0.1 % each: Cr and Fe.ColorColorlessOptical dataIsotropic, N=1.340StructureCubic, Ia3d (230), Z=8, garnet type. Thestructure was determined by Menzer[1930]and refined by Geller [1971].d (A)4.954.283.2433.0292.7112.5842.4772.3762.2132.1441.9661.9171.7881.7501.7151.6811.6491.6191.5391.5150Internal standard Ag, a = 4.08641 ACuKai X= 1.54056 A; temp. 25 °CI1310055535171355065520210516113079hkl2112203214004203324224315214406116206314445436407216427328002$(°)17.8920.7327.4829.4633.0234.6836.2437.8340.7442.1146.1347.3951.0552.2453.3854.5355.6956.8160.0561.12Lattice constantsNBS, sample at 25 °C ——————————a(A)12.1254±.0002Density(calculated) 2.770 g/cm 3 at 25° C. (basedon a Na to Li ratio of 1:1).Reference intensityI/I . - 1.0' corundumAdditional patterns1. PDF card 2-1282 [Menzer, 1930]ReferencesGeller, S. (1971). Am. Mineralogist56, 18.Menzer, G. (1930). Z. Krist. 75, 265.1.4931.4701.4491.4291.4101.3731.3561.3241.30771.29281.27801.25091.23781.22521.20111.18951.15641.12611.11631.107232283212226423812233581182065382283175284084292166485193284494110-1-110-2-010-3-110-4-010-3-310-4-262.1563.2064.2165.2466.2568.2669.2571.1872.1873.1474.1376.0276.9777.9179.7880.7283.5386.3287.2688.1723

Lithium Sodium Aluminum Fluoride, cryolithionite, Li 3Na 3AI 2 F 12 - continuedd(A)1.09801.08041.07161.04751.04001.02481.01771.01071.0035.9965.9903.9836.9772.9646.9413.9356.9193.9139.9037.8987.8939.8890.8750.8705.8617.8573.8448.8408.8328.8249.8212.8138I22221122

Magnesium Aluminum Oxide (spinel), MgAI 20 4SampleThe sample was furnished by H. R. Shellof the Bureau of Mines, College Park,Md.He used a carbon electrode furnace andremoved an excess of MgO with hot HClafter crushing.ColorColorlessOptical dataIsotropic, N=1.718StructureCubic, Fd3m (227), Z=8. The structurewas determined by Bragg [1915] and Nishikawa[1915] . Atomic parameters were refined by Bacon [1952] , using neutron defraction.d(A)4.662.8582.4372.3352.0201.6501.55541.42891.36621.27801.23301.21871.16661.13201.08020Internal standard Ag, a = 4.08641 ACuKfll A= 1.54056 A; temp. 25 °C73540100365945553381525hkl11122031122240042251144053162053362244471164220(°)19.0231.2736.8438.5344.8355.6459.3765.2468.6474.1377.3278.4082.6485.7690.97Lattice constants1.05241.01040.9527.9334.927412728173180082275166294.1099.34107.90111.22112.32NBS, sample at 25 °C ————— - ————a(A)8 f|Q*3 1±.0001.9038.8872.8820.8616.847461

Magnesium Sulfite Hydrate, MgS0 3 -6H 2 0SampleThe sample was formed by precipitationwhen aqueous solutions of MgCl2 •6HS 0 andH2 S0 3 were mixed.ColorColorlessOptical dataUniaxial (-), N0=1.51, Ne=1.46StructureHexagonal, R3 (146), Z=3 . The structurewas determined by Klasens et al. [1935],d(A)5.854.4163.9053.5243.0252.9262.7582.5522.4972.439oInternal standard W, a = 3.16516 ACuK fll A = 1.54056 A; temp. 25 °C/1285100465305041030hkl1011100120210032022113001131222&(°)15.1420.0922.7525.2529.5030.5332.4335.1435.9436.82NBS, sample at 25 °CLattice constants0a(A)8.8385±.00040c(A)9.080±.0012.2082.1782.0671.9521.9241.8721.7861.7671.7641.7252471012230112220104131024,303312401214,22301504232140.8341.4343.7546.4947.2148.6051.1151.7051.7753.05Density(calculated) 1.723 g/cm 3 at 25° C.Reference intensityI/I = 1.6Major impurities0.001-0.01% each: Ca and Fe0.01 -0.1 % each: Na1.6701.6381.5511.5381.5131.5101.4731.4631.4511.43151.38921,37841.35911.31601.301413332

Magnesium Sulfite Hydrate, MgS0 3 -6H 20 - continuedd(A)Ihkl2u(«)1.21981.21251.18391.17591.170122

Manganese Chloride Hydrate, MnCI 2 *4H 20SampleThe sample was recrystallized from anaqueous solution at room temperature.0Internal standard W, a = 3.16516 ACuKaj * = 1.54056 A; temp. 25 °CColorLight pinkOptical dataBiaxial(+), Na =1.583, Np=1.608, N Y =1.6672V is large.d(A)7.235.525.155.004.943/440813100hkl110200Oil10111120(°)12.2416.0417.2217.7417.93StructureMonoclinic, P2 l /n (14), Z=4. The structure was determined by Zalkin et al.[1964].4.7664.4294.3714.0643.760257525206210,02011112021102118.6020.0320.3021.8523.64Lattice constants3.6753.6003.5193.4503.43365115712122021112131024.2024.7125.2925.8025.93NBS,sampleat 25 °C0a(A)11.194±.0010t>(A)9.527±.002c(A)6.202±.001Density(calculated) 2.016 g/cm 3 at 25° C.Reference intensityI/I A = i.ofl( 9)99.75±.013.2683.2183.0572.9132.8172.8082.7782.7622.7532.7092.5952.5892.5722.4992.48518114075151225354030452071720221311002320,012031311321212230112231411,122022321,20231227.2127.7029.1930.6731.7431.8432.1932.3932.5033.0434.5434.6234.8635.9036.122.4352.4032.3872.3432.3281099128231330420421140,33136.8937.4037.6638.3838,652.2992.2652.2122.1982.185479156411322222,132501240,41239.1539.7740.7541.0341.2928

Manganese Chloride Hydrate, MnCI 2 *4H 20 - continuedd(A)7hkl2t(°)2.1492.1422.1212.0542.031131952010141,510511312,42143142242.0142.1642.6044.0644.57Additional patterns1. PDF card 1-0362 [Hanawalt et al., 1938]2.0181.9991.9791.9461.9311.9051.8981 0 8861.8711.8581018253617192085241332,34032210351111343114202341244.8945.3445.8146.6347.0147.7047.8948.2148.6248.99ReferencesHanawalt, J.D. f H.W. Rinn and L. K. Frevel(1938). Ind. Eng. Chem. Anal. Ed. 10,457.Zalkin, A., J. D. Forrester and D. H. Templeton(1964). Inorg. Chem. 3, 529.1.839Io8331.8171.8091.806656178600,242432611151522,61049.5249.6950.1650.4050.501,780915151.2929

Manganese Cobalt Oxide, MnCo 20 4SampleMnCl 2 and CoCl 2 in a molar ratio of 1:2were treated with HNO 3 . The product wasdried, heated to 760 °C for one hour andthen heated overnight at 720 °C.ColorOpaque blackStructureCubic, Fd3m (227), Z=8, spinel type[Holgersson and Karlsson, 1929].Lattice constantsNBS, sample at 25 °C —————————a(A)8.269±.001d (A)4.782.9252.4932.3882.0670Internal standard Ag, a = 4.08641 ACuKGl A = 1.54056 A; temp. 25 °C1.6871.59111.46131.39761.30771.26101.24631.19351.15791.1047I14351001020930352365213hklill22031122240042251144053162053362244471164220(°)18.5430.5436.0037.6443.7654.3357.9163.6266.8972.1875.3076.3580.3983.4088.42Density(calculated) 5.564 g/cm 3 at 25° C.1.07641.03360.9746.9550932573180082275191.3896.35104.44107.52Reference intensityI/I , - 1.3corundum ~~Additional patterns1. PDF card 1-1130[Hanawalt et al. f 1938]ReferencesHanawalt, J.D., H.W. Rinn, and L.K. Frevel(1938). Ind. Eng. Chem. Anal.Ed. 10, 457.Holgersson, S., and A. Karlsson (1929). Z.anorg. u. allgem. Chem. 183, 384 „30

Potassium Aluminum Sulfate, KAI(S0 4 ) 2SampleThe sample was prepared by heatingKAl(S04 ) 2 -12HS 0 at 700 °C for 15 hours.ColorColorlessd (A)1.8191.7941.7661.6211.597I139

Potassium Barium Nickel Nitrite, K 2 BaNi(N0 2) 6SampleThe sample was prepared from an aqueoussolution of BaCla, NiCla and KNOa according to the method given by Ferrariand Colla [1931] .d(A)oInternal standard W, a = 3.16516 ACuKaj A = 1.54056 A; temp. 25 °C/hkl20 (°tColorMedium yellowOptical dataIsotropic, N=1.598StructureCubic, Fm3m (225), Z=4, isostructuralwith other hexanitrites [Ferrari andColla, 1933]; structure of this group ofcompounds was determined by van Drieland Verweel [1936].Lattice constantsNBS, sample at 25 °C ——————————Density(calculated) 2.904 g/cm 3 at 25° C.Reference intensityI/I A - 2.9' corundum ~"Additional patterns1. Ferrari and Colla [1931]a(A)10.797±.0016.225.393.8153.2542.6992.4772.4142.2032.0781.90801.82471.79941.70691 . 64641.62771.55801.51141.49691.44231.40561.34921.31871.30941.27211.24701.23871.20721.18511.17821.15071.13161.10181.08521.07961.058615901003095255585920711205633725653583563431323611120022031140033142042251144053160062053362244471164064273180073382082275166284091184266493184493310-0-010-2-014.2216.4323.3027.3933.1736.2437.2240.9343.5147.6249.9450.6953.6555.7956.4959.2661.2861.9464.5666.4669.6371.4872.0774.5376.3076.9079.3081.0881.6584.0485.8088.7190.4391.0393.38Referencesvan Driel, M. , and H.J. Verweel (1936)* Z.Krist. 95, 308.Ferrari, A., and C. Colla (1931), Atti realeaccad. nazl. Lincei 14, 435.Ferrari, A., and C. Colla (1933). Atti realeaccad. nazl. Lincei 17, 390.321.04391.03901.00691.0025.9858.9735.9542.9433.9398.9260333561234395110-2-295310-4-010-4-211-1-188097110-4-410.6-095.1095.6999.82100.42102.78104.60107.65109.48110.09112.59

Potassium Calcium Nickel Nitrite, K 2CaNi(N0 2 ) 6SampleThe sample was prepared from an aqueoussolution of CaCla / NiClg and KNOa according to the method given by Ferrariand Colla [1931].ColorMedium yellowOptical dataIsotropic, N=l.640StructureCubic, Fm3m (225), Z=4, structure determined by van Driel and Verweel [1936],isostructural with other hexanitrites[Ferrari and Colla, 1933].d(A)5.985.183.663.1242.9932.5912.3772.3172.1161.9941.8331.7521.7261.6381.4950Internal standard W, a = 3.16516 ACuK^ A = 1.54056 A; temp. 25 °C7640553301002457551832152hklill2002203112224003314204225114405316006204442&(°)14.8017.1224.2728.5529.8334.5937.8138.8442.6945.4449.7152.1753.0156.0962.02Lattice constantsa(A)Io4501.43661.38471.34881.295033252571164064273180064.1764.8567.6069.6573.00NBS, sample at 25 °C ——————————10,361±.0011.26591.22071 0 19641.18861.15842423573382275166284074.9678.2580.1680.7983.36Density(calculated) 2.705 g/cm 3 at 25° C.1.13101.10451.05761.0161263584266484410*2-085.8588.4493.4998.59Reference intensityI/I . _ 1.61 corundum ~Additional patterns1. PDF card 3-837/(Michigan Alkali Co.Wyandotte, Michigan)2. van Driel and Verweel [1936]3. Ferrari and Colla [1931]Referencesvan Driel, M., and H.J. Verweel (1936), Z,Krist. 95, 308.Ferrari, A., and C. Colla (1931), Atti realeaccad. nazl. Lincei 14, 435.Ferrari, A., and C. Colla (1933), Atti realeaccad. nazl. Lincei 17, 390.33

Potassium Copper Chloride Hydrate (mitscherlichite), K 2 CuCI 4 *2H 20SampleThe sample was prepared by slow evaporation at room temperature of a 2:1 aqueous solution of KCl and CuClg .ColorBrilliant greenish blueOptical dataUniaxial (-), No=1.638, Ne=1.613StructureTetragonal P42 /mnm (136), Z=2, isostructuralwith (NH4 ) 2 CuCl4 • 2H2 0 and R^GuCl*•2Ha O [Hendricks and Dickinson, 1927].The structure was refined by Chrobak[1934] .d(A)0Internal standard Ag, a = 4.08641 ACuKa! A= 1.54056 A; temp. 25 °C5.425.273.963.733.3353.1643.0722.7112.6352.54977072061450259510012hkl10111000220021011221120222021226(0)16.3416.8122.4423.8226.7128.1829.0433.0134.0035.18Lattice constants2.4862.3712.1922.0672.0241157914103301222213,32031236.1037.9141.1543.7644.75NBS, sample at 25°Ca(A)7.454±.001Density(calculated) 2.416 g/cm 3 at 25° C.c(A)7.909±.0011.9991.9771.8641.8071.7631.7011.6431,6271.6061.58141.547692517532545253321004223,400303,41041121441232333222410545.3345.8648.8250.4651.8253.8755.8856.5157.3158.3059.70Reference intensity' corundum "~ *Additional patterns1. Chrobak [1934]2. PDF card 1-1073 [Hanawalt et al.,1938]3. PDF card 13-203 [Kleber and Steinike-Hartung, 1959]ReferencesChrobak, L. (1934). Z. Krist. 88, 35.Hanawalt, J.D., H.W. Rinn, and L.K. Frevel(1938). Ind. Eng. Chem. Anal.Ed.10, 457.Hendricks, S.B. and R.G. Dickinson (1927)*J. Am. Chem. Soc. 49, 2149.Kleber, W. and U. Steinike-Hartung (1957).Z. Krist. Ill, 213.Major impurities0.01 -0.1 % each: Si34

Potassium Iron Cyanide, K 3 Fe(CN) 6SampleThe sample was obtained from City Chemical Corp., New York, N.Y.oInternal standard W, a = 3.16516 ACuKa t A = 1.54056 A; temp. 25 °CColorDeep reddish orangeOptical dataBiaxial(+) N =1.561, N0 =1.562, N =1.576,2V is medium? Yd(A)6.746.545.905.214.691/123272hkl200Oil111,111020211,2112*013.1213.5315.0016.9918.90StructureMonoclinic, P2 I /c (14), Z = 4 [Gottfriedand Nagelschmidt, 1930].4.1204.0123.7423.3673.20510020375310,220102,102112,112212, 400, +031,41021.5522.1423.7626.4527.810a(A)Lattice constants0b(A)c(A)£(°)3.1783.0863.0672.9452.93843035I 45 j>

Potassium Iron Cyanide, K 3 Fe(CN) 6 - continuedd(A)1.68121.65711.63411.60271.59261.56161.54291.53411.51071.5025I62213

Potassium Iron Fluoride, K 3 FeF 6SampleThe sample was prepared by adding a solution of FeCl3 in HF to a solution ofKF with an excess of HF.ColorColorlessOptical dataIsotropic, N s=fine grained)(sample was veryStructureCubic/ Fm3m (225), Z=4, [Bode and Voss,1957]% Peacock [1957] found KaFeFe to betetragonal with a=8.59 and c=8.66. Oursample showed no evidence of being noncubic.Lattice constantsNBS, sample at 25 °C ——————————a(A)8.622±.001d (A)4.984.3123.0482.5982.4902.1551.9781.9291.7601.6581.5241.4571.4371.3641.31511.24461.20741.1519oInternal standard W, a = 3.16516 ACuKaj A = 1.54056 A; temp. 25 °CI3017100384033257114351334hkl11120022031122240033142042251144053160062053344471164220(°)17.7920.5829.2834.5036.0441.8845.8447.0851.9255.3560.7463.8264.8468.7871.7176.4779.2883.93Density(calculated) 2.975 g/cm 3 at 25° C.Reference intensityI/I , '- 2.4corundum ~~Additional patterns1. PDF card 3-0589 [Dow Chemical Co.]Midland, Mich.ReferencesBode, H., and E. Voss (1957). Z. Anorg.Allgem. Chem. 290, 1.Peacock, R. D. (1957). J. Chem. Soc. 1957,4684.37

Potassium Nitrite, KN0 2SampleReagent grade KNOa was obtained from Allied Chemical Co., Morristown, N.J. Thesample was maintained in a dry atmosphere.d(A)0Internal standard W, a = 3.16516 ACuKai * = 1.54056 A; temp. 25 °C7hkl29 C)ColorColorlessOptical dataUniaxial (-) NQ=1.466, Ne

Potassium Oxalate Hydrate, K 2 C 20 4 'H 20SampleThe sample was reagent grade materialrecrystallized from aqueous solution.ColorColorlessOptical dataBiaxial(+) Na =1.440,2V is very large.Ny -1.562.StructureMonoclinic, A2/a (15), Z=4 [Hendricks,1935] . Two refinements of the structurehave been published [Chidambaram et al.,1964] and [Pedersen, 1964].NBS,sampleat 25 °C0a(A)10 . 684±.001Lattice constantsQb(A)6.182±.001C(A)9.226±.001Density(calculated) 2.148 g/cm 3 at 25° C.Reference intensityI/I . - 1.0corundum "~0(°)110.77±.01d(A)5.0244.9904.9164.3164.1604.0483.9803.2253.0872.9542.8072.7492.6952.6282.6062.5982.5632.5462.4972.4562.4472.3272.2662.2402.1882.1562.0792.0262.0041.9431.9160Internal standard Ag, a = 4.08641 ACuKa! A= 1.54056 A; temp. 25 °C720253020525410403510025145i 35 r; l2510557560815561214201063hklOil200in002111202211211020,311120202113213220013402122311400222411122320322413004222404031,51142023120(0)17.6417.7618.0320.5621.3421.9422.3227.6428.9030.2331.8532.5433.2134.0934.3834.4934.9835.2235.9336.5636.6938.6639.7540.2341.2241.8643.5044.6945.2046.7247.42Additional patterns1. PDF card 14-760[HanawaIt et al.,1938]1.9101.8911.8451.8351.8338224951340222412432247.5848.0849.3549.6449.711.8091.7931.7801.7691.750105581231324,313602024,21552250.4050.9051.2751.6152.2339

Potassium Oxalate Hydrate, K 2C 20 4 'H 20 - continuedd(A)1.7441.7381.6971.6871.6771.6641.6601.6311.61251.570673641245235fcA??315115,5112336115206001244314225242&D52.4352.6153.9854.3254.6855.1455.2956.3857.0758.74ReferencesHanawalt, J.D., H.W. Rinn, and L.K. Frevel(1938). Ind. Eng. Chem.Anal.Ed. 10, 457.Hendricks, S.B. (1935). Z. Krist. 91, 48.Chidambaram, R.,A. Sequeira, and S.K. Sikka(1964). J. Chem. Phys. 41, 3616.Pedersen, B.F. (1964). Acta Chem. Scand.18, 1635.1.56861.55541.54291.53321.497132462413,515115622206,224233,40658.8259.3759.9060.3261.931.49101.46441.45381.44351.42661452161114271124252262.2163.4763.9964.5065.361.41601.40431.39611.38611.374525325142404342,602333,51323565.9166.5366.9767.5268.171.35071.33641.33201.32741.325322124606631802442,43563369.5470.3970.6670.9471.071.29911.27891.27491.24891.237433322526,804424,342811,433542,80062672.7374.0774.3476.1677.0040

Potassium Selenate, K 2Se0 4SampleThe sample was precipitated by addingH2 SeCU to K2 CO 3 in solution.oInternal standard W, a = 3.16516 ACuKaj A = 1.54056 A; temp. 25 °CColorColorlessOptical dataBiaxial(-f) Na=1.535, Ng=1.539, Ny=1.545,2V is large [Tutton, 1897].d (A)5.234.3204.3043.8273.594717on \ou \305hkl0201201112002102*016.9420.5420.6223.2224.75StructureOrthorhombic, Pnam (62), Z=4 [Gattow,1962], isostructural with pKaSO*. Thestructure was refined by Kalman et al.[1970] .NBS, sample 25 °CLattice constantsa(A)7.654±.001b(A)10.468±.001c(A)5.996±.0013.5063.2263.1753.0913.0833.0152.8032.7472.6952.6172.6022.5792.4772.3702.362

Potassium Selenate, K 2Se0 4 - continuedd (A)1.6361.6161,5941.5871. 5801.56571.56231.56001.55611,5345I596555765

Potassium Sodium Aluminum Fluoride (elpasolite), K 2 NaAIF,SampleMade by dissolving aluminum in HF, adding KsCOs and NasCOs, drying, melting,and annealing 72 hours at 650 °C.ColorColorlessOptical dataIsotropic, N=1.376 [Frondel,1948] .StructureCubic, Fm3m (225), 2=4, by analogy withKaFeF6 and other hexafluorides. Helmholz[1959] also obtained data consistentwith Fm3m using a synthetic sample ofK2NaAlF6 in which a small amount of aluminum was replaced by iron. The naturalmineral elpasolite, KsNaAlF6 / has beenreported to have space group Pa3 (205)[Frondel, 1948],[Menzer, 1932]. Stewardand Rooksby [1953] gave the space groupPa3 (205) but their photographed patternas published does not show the extralines that would require Pa3.d(A)4.6874.0592.8682.3452.0301.8641.8171.6581.56331.43561.37301.35391.28411.22451.17221.13731.08541.05721.01520.9924Internal standard W, a = 3.16516 ACuKaj A = 1.54056 A; temp. 25 °CI2041007590413063511127821123

Rubidium Selenate, Rb 2 Se0 4SampleThe sample was precipitated by adding asolution of RbgCO 3 to one of0Internal standard Ag, a = 4.08641 ACuKa, A= 1.54056 A; temp. 25 °CMajor impurities0.01 -0.1 % each: Al, Ba, Cr, and Na0.1 -1.0 % each: MgColorColorlessd (A)5.424.484.4513.9903.7403,6267479161118hkl0201201112002101212e(*)16.3519.8119.9322.2623.7724.53Optical dataBiaxial(+),N =1.535, Ng -1.539, N =1.545,2V is large [Tutton, 1897]. YStructureOrthorhombic, Pnam (62), Z=4, isostructuralwith K, Cs, and Tl selenates andwith e-KgS0 4 [Gattow, 1962], The structure of Kg SeO 4 was determined by Ka'lma'net al. [1970].3,3513.2853.2123.2023.1133.0882.9022.8492.7042.6761411> 100 (A)c(A)2.5842,5432.4542.3832.36625442013310122231311,21214134o6935.2736.5937.7237.99NBS, sample at25 °C —— - -7.979±.00110.820±.0016.174±.0012.2512.2392.2252.1422.1058143085132240321,22233024140.0340.2540.5042.1542.93Density(calculated) 3.919 g/cm 3 at 25° C.Reference intensity2.0882.0422.0231.9941.98210210106150051331,23240031243.2944«3244.7745.4645.75I/I , - I Q' corundum ~~ J. . ,/ReferencesGattow, G. (1962). Acta Cryst. 15, 419.Kalman, A., J. S. Stephens, and D. W. J 0Cruickshank (1970). Acta Cryst. B26,1451.Tutton, A.E.H. (1897). J 0 Chem. Soc. 71,846.1.9621.9011.8981.8701.8291.8131.8021.7871.7591.74514107316201729410250401123,411203341,242060,213033332,160430,13346.2347.8047.8848.6549.8150.2950.5751.0851.9452.3844

Rubidium Selenate, Rb 2Se0 4 - continuedd(A)1.7301.6921.6801.6751.6561.6431.6311.6191.6171.6111.6051.5871.5581.5431.5301.5201.5001.4911.4871.46711.45031.43241.42041.39611.39381.39121.37451.37091.36181.35291.34141.33701.33071.30701.30361.29131.28421.27051.26561.25721.25271.2389I7478241221249786211112214558421154352221332hkl152161431,350402412260233351,252342313143261062004520432071053521450361,262403531,413253343224540522172080541234433461181620550,2632444435515130822G( Q)52.8854.1654.5954.7455.4555.9056.3856.8256.9157.1357.3858.0659.2759.8760.4460.9161.8162.2062.4263.3464.1665.0665.6866.9767.1067.2468.1768.3768.8969.4070.0970.3670.7472o2272.4473.2473.7174.6474.9875.5775.8976.8945

Silver Cyanide, AgCNSampleThe sample was obtained from the reaction of solutions of KCN and AgN0 3 .0Internal standard W, a = 3.16516 ACuKaj A = 1.54056 A; temp. 25 °CMajor impurities0.001-0.01% each: Al, ca, Cr, Fe, Si.0.01 -0.1 % each: Ba and Mg.ColorColorlessd(A)3.6993.0012.3452.3291.8481.841I45100\ 18

Silver Oxalate, Ag 2C 20

Sodium Chromium Oxide, Na2Cr0 4SampleThe sample was prepared by heatingNa 2 Cr0 4 -4H 2 0 at 600 °C for 60 hours.ColorBrilliant yellowOptical dataBiaxial ( + ) , Na = 1.765, NY = 1.788, 2V islarge .StructureOrthorhombic, Amam (63), 2=4. The structure was determined by Miller [1936];the space group designation was corrected by Niggli [1954] .d(A)4.964.644.0733.8853.5742.9322.8972.7332.5532.477oInternal standard W, a = 3.16516 ACuKaj A = 1.54056 A; temp. 25 °CI2046565406010070525hklOil0201111202000022110311310222& (°)17.8819.1221.8022.8724.8930.4630.8432.7435.1236.23NBS,sample at 25 °CLattice constants0a(A)7.1462±.00040b(A)9.2635±.0004Density(calculated) 2.771 g/cm 3 at 25° C.Reference intensityI/I = 1.20c(A)5 . 8640±.00032.3422.3172.2032.1712.1192.0361.9441,8481.7951.7871.7611.7151.6861.6811.6611.6511.61951.60891.58361.543843313819124151834866111912212204014023132022224011333140014215121341134003324213325106038.4138.8340.9341.5642.6344.4646.6849.2750.8151.0851.8753.3854.3754.5555.2755.6356.8057.2158.2159.86Additional patterns1. PDF card 1-927 [Hanawalt et al.,1938]1.52561.50901.49511.46611.449343147240216043100442260.6561.3962.0263.3964.21ReferencesHanawalt, J.D., H.W. Rinn, and L.K. Frevel(1938).Ind. Eng. Chem. Anal.Ed. 10, 845.Miller, J.J. (1936). 2. Krist. 94, 131.Niggli, A. (1954). Acta Cryst. 7, 776.1.44531.41871.37181.36641.357015544342351124062,52033364.4165.7768.3268.6369.1748

Sodium Chromium Oxide, Na 2Cr0 4 - continuedd(A)1.34191.32151.30141.27621.27371.25871.23851.21321.20581.19121 C 18501.17051.16821.15771.14851.14511.14321.13321.11121,10621.09631.09171.08491.08381.07691.07321.06501.06321.04781.04171.01891.01361.01101.00350.9962752422117112522132312112112212111122hkl162153224262442253044,522433324600362244460611,080115513180404551215035631462135082622182064273380264091613191642,33520(*)70.0671.3172.5874.2574.4275.4676.9278.8379.4180.5881.0982.3182.5083.4284.2484.5584.7285.6587.7788.2789.2889.7590.4790.5891.3391.7492.6592 0 8594.6495,3798.2398.9299.27100.28101.2949

Sodium Chromium Oxide Hydrate, Na 2 Cr0 4 *4H 2 0SampleThe sample was obtained from J.T. BakerChemical Co., Phillipsburg, N.J. and wasrecrystallized from aqueous solution atroom temperature,d(A)0Internal standard Ag, a = 4.08641 ACuKd! X= 1.54056 A; temp. 25 °C7hkl20(°)ColorBrilliant yellowOptical dataBiaxial(+) Na=1.564, Np =1.568, Ny =1.590,StructureMonoclinic, P2 l /c (14), [Geslin et al. f1968] . Z is assumed to be 4.8.125.995.915.605.295.2245.0554.8784,4674.08861120845780510013Oil100002020111,110012021102112121,12010.8914.7814.9715.8216.7416.9617.5318.1719.8621.723.7123.6663.5693.5553.2161012304055013121113031,11202323.9524.2624.9325*0327.72NBS,sampleat 25 °C0a(A)6.199±.001Lattice constantsb(A)11.183±.001C(A)12.218±.001£(°)104.94±.013.1703.1623.1223.1132.9952.9892.9632.8952.8652.855}45 {106}25|50202025131130123122200211132212,21011401428.1328.2028.5728.6529.8129.8730.1430.8631.1931.31Density(calculated) 1.899 g/cm 3 at 25° C,2.7952.7192.7122.6582.64731416171104004122121113332.0032.9133.0033.6833.83Additional patterns1. PDF card 1-334 [Hanawalt et al.,1938]2. Geslin et al. [1968],2.6412.6142.5352.5292.468851194132,220,+123141,14004222333.9234.2735.3835.4736.38ReferencesGeslin, M., M. Gaultier and G. Pannetier(1968). Bull.Soc.Chim.France, 1968^3,939Hanawalt, J.D., H.W. Rinn, and L.K. Frevel(1938). Ind. Eng. Chenu Anal.Ed.10, 457.2.4582.4262.4122.3832.35948834221142,141104214,23111436.5237.0237.2437.7238.1250

Sodium Chromium Oxide Hydrate, Na2 Cr0 4 '4H 20 - continuedd(A)2.3392.3152.2782.2452.2222.2122.1972.1762.1032.0952.0412.0362.0312.0292.0262.0221.9941.9671.9601.9391.9311.9231.9041.8971.8751.8641.8561.8381.8031.784I495205324414341 11J I1234457141545710791110hkl232133,034043143125233051025215150,213,+234232,144143,106,+044,135134,312311035,115006243016322,321153125304204060,311026,216,+244045,332153,226,+20 r)38.4638.8739.5240.1440.5640.7541.0541.4742.9743.1544.3444.4544.5844.6244.7044.7945.4546.1046.2946.8147.0247.2347.7347.9248.5248.8249.0349.5650.5851.17d(A)1.7781.7621.7371.7241.7001.6951.6831.6671.6561.6391.6231.6091.5951.5821.5761.56191.54361.52311.51861.49951.49101.47571.46241.44931.44191.43441.41281.40581.3885/631244436552357102222335 1 131243hkl135,160+333312117245243063,325017,127341154,215340,055316,046335,227071,260163,064326,246170,253,+413172,171404353,336165,008,+018,065424327228138265,346+081&>(*)51.3351.8552.6453.0853.8954.0554.4655.0455.4356.0656.6657.1957.7558.2858.5159.1059.8760.7660.9661.8262.2162.9363.5764.2164.5864.9666.0866.4567.3951

Sodium Hydrogen Sulfate Hydrate, NaHS0 4 'H 2 0SampleThe material was from the SpecialtyChemicals Div. of Allied Chemical Corp.,Morristown, N. J.ColorColorlessOptical dataBiaxial(-) Na=1.43, N0=1.46, Nv=1.48, 2Vis large.d(A)5.185.1103.9093.6333.5570Internal standard W, a = 3.16516 ACuKd! A = 1.54056 A; temp. 25 °CI1935530100hkl111Oil020211111,2002&( .)17.1217.3422.7324.4825.01StructureMonoclinic, Aa(9),Z=4. The structure wasdetermined by Pringle and Broadbent,[1965].3.4623.4223.3782.7592.629705518201520212000212222025.7126.0226.3632.4234.08NBS,sampleat 25 °C0a(A)8.213±.001Lattice constants0b(A)7.812±.001c(A)7.805±.0010(°)120.04°±.012.5912.5552.5502.5092.4382.4312.4212.2132.2042.1822.1642.1592.0542.0271.99921 9 /J66711911106945522202231121113103111331332213101312240232020234.5935.0935.1635.7636.8436.9537.1140.7340.9141.3441.7141.8144.0644.6845.32Density(calculated) 2.124 g/cm 3 at 25° C.Reference intensityI/I , - 1.6' corundum ""Additional patterns1. PDF card 1-546 [Hanawalt et al.,1938]1.9511.9191.8931.8891.8831.8571.8391.8301.8181.7802245424310620441131141314023111323342222246.5147.3248.0348.1348.2849.0249.5349.7850.1451.291.7781.7451.7311.7271.7113245440022440433324051.3452.4052.8052.9753.5252

Sodium Hydrogen Sulfate Hydrate, NaHS0 4 -H 2 0 - continuedd(A)7hkl20(°)1.7031,6901.6851.6181.59168623033042,00412442051353.7854.2454.4256.8557.93ReferencesHanawalt, J.D. , H.W. Rinn and L.K. Frevel,(1938). Ind. Eng. Chem. Anal.Ed. 10,457,Pringle, G.E., and T.A. Broadbent (1965).Acta Cryst. 19, 426.1.5761.5611.5501.5271.52312211431,34233102451105158.5159.1259.5960.5860.771.50851.48031.44451.42311.414531

Sodium Iron Fluoride, Na 3 FeF 6SampleThe sample was prepared by adding FeCl 3solution to one containing NaF in HF.ColorColorlessd(A)2.5422.4842.4242.39876202515hkl1202101211032*035.2836.1337.0637.47Optical dataAlmost isotropic, lOl.41,very finely divided.StructureMonoclinic, Z«2 [Croft and Kestigian,1968], Space group P2 1 /n (14), by analogy with the powder pattern of cryolite,Na 3 AlF 6 .NBS,sampleat 25 °C0a(A)5.513±.001Lattice constantst>(A)5.728±.001C(A)7.964±.001Density(calculated) 3.154 g/cm 3 at 25° C.Reference intensityI/I A = °' 4Additional patterns1. PDF card 1-0991Midland, Michigan]2. PDF card 21-11251968]d(A)4.654.544.523.983.563.552.8642.8192,8062.7560O90.40±.01[Dow Chemical Co.,[Croft and Kestigian0Internal standard W, a = 3.16516 ACuK^ A = 1.54056 A; temp. 25 °C/75•^ r} \1009835}95{25hklOil101101002,1101111110201121122002*.C)19.0719.5219.6222.3424.9825.0431.2031.7231.8732,46542.3842.3762.3262.2122.2022.1462.1392.1151.9871.9471.9291.9251.8571.8381,8041.7921.7801.7761.7601.7501.7221.7071.6431.6341.6191.6061.5981.5471.5411.5351.5191.51631.49081.45791.43181.40961.40231,38591.37821.3657}40{41116, ,J 15 I485664371710}25{16524302574525789674341110332103211022113113122122212220023221221031123130301222114131,131310032311132,132024204312312320231015321321,303133232040224,041224140400,034141,141ReferencesCroft, W.J. and M. KestigianRes. Bull, 3, 571.37,7037.8338.6740.7640.9542.0742.2142.7245.6246.6147,0747.1849.0049.5450.5450.9151.2851.4051.9152.2253.1653.6555.9056.2456.8157.3257.6459.7460.0060.2560.9361.0662.2263.7965.0966.2566,6467.5367.9668.67(1968). Mat.

Sodium Selenate, Na2Se0 4SampleThe sample, obtained from K & K Laboratories, Inc., Plainview, N.Y. , was recrystallizedand dried at 50 °C.ColorColorlessOptical dataBiaxial(+), Na =1.506, N p =1.520, NY -1.5342V is large.StructureOrthorhombic, Fddd (70), Z=8, isostructuralwith Na 2 SO 4 , form V (thenardite).The structure was determined by Naray-Szabo and Argay [1963] and refined byKalman and Cruickshank [1970].d (A)4.8313.9593.2733.1502.8842.7462.6182.5432.4212.4182.0121.9781.9401.9181.865oInternal standard W, a = 3.16516 ACuKaj A = 1.54056 A; temp. 25 °C/100457045905551\ 25 (' *81023516hkl1112201310403110222024003312222424402603514222«(«)18.3522.4427.2228.3130.9832.5834.2235.2637.1037.1545.0145.8346.7947.3748.78Lattice constantsa(A)b(A)C(A)1.8011.7531.7281.7001.659223012133531062,31317144250.6352.1352.9553.8755.33NBS , sample-,-1- 9 c °(~>10.171±.0011 "~) C Q"7±.0016.1038±.00031.63701.61041.57331.56351.5373512259620,26233308015337156.1457.1558.6359.0360.14Density(calculated) 3.212 g/cm 3 at 25° C.Reference intensity' corundum = •*• • 81.52581.48161.43361.42951.42371.40471.37291.36061.35101.34823868526124004602353462,51322471104453319128260.6462.6565.0065.2165.5166.5168.2668.9669.5269.69Additional patterns1. PDF card 1-272 [Hanawalt et al.,1938]2. Naray-Szabo and Argay [1963]1.33961.33791.33601.32531.31841313112773148017324466070.2070.3170.4271.0771.5055

Sodium Selenate, Na2Se0 4 - continuedd(A)1.31521.30841.28141.26471.2523/73122hkl5714044243913732fJ(°)71.7072.1373.9075.0475.92ReferencesHanawalt, J.D. , H.W. Rinn, and L.K. Frevel(1938). Ind. Eng. Chem. Anal.Ed. 10, 457Kalman, A. and D.W.J. Cruickshank (1970).Acta Cryst. B26, 436.Naray-Szabo, I. and Gy. Argay (1963). ActaChim. Hung. 39, 85.1.23251.22181.20801.20651.1993112227512-10-044411526477.3678.1779.2379.3579.921.17741.16371.15371.14501.1440231227130-10-282219331581.7282.8983.7784.5584.651.13831.13461.13251.11811.1162111347332-10-25911-11-162485.1785.5185.7187.0987.271.10761.09551.09201.07881.07415332133508415568293188.1389.3689.7291.1291.631.07061.06781.05811.04911.0452221112843-11-14-10-20-12-035592.0292.3493.4394.4994.9556

Tin Sulfide (berndtite), beta, SnS 2SampleThe sample was prepared by heating NH^Cl,Sn amalgamated with Hg, and sulfur inexcess until all the Hg was driven off.The remaining material was recrystallizedby sublimation within an almost closed tube.Major impurities0.01 -0.1 % each: Al, Bi, Cd, Hg, and Pbd(A)5.893.1622.9512.7842.155oInternal standard W, a = 3.16516 ACuKa! A = 1.54056 A; temp. 25 °C71003055525hkl0011000021011022»(°)15.0228.2030.2632.1241.88ColorDeep yellow brown1.96651.82401.7431'1.66931.5801530208400311011110320046.1249.9652.4554.9658.35StructureHexagonal, P3ml (164), Z = l, isostructuralwith Cdlg [oftedal, 1928] .NBS, sample at 25 °CLattice constantsa(A)3.6486±.0001Density(calculated) 3.854 g/cm 3 at 25° C.Reference intensity' corundum ~~ 4.6C(A)5.8992±.0003PolymorphismMoh [1969] found three additional linesin the pattern of this phase and concluded that it was of lower symmetry. A-bove 692 °C SnS 2 appears in a differentcrystal form ( a ). PDF card 21 -1231[Guenter and Oswald, 1968] represents apolytype with c_ doubled which we did notobserve.ReferencesGuenter, J.R. and H.R. Oswald (1968). Naturwiss.55, 177.Hanawalt, J.D., H.W. Rinn, and L.K. Frevel(1938). Ind. Eng. Chem. Anal.Ed.10, 457.Moh, G.H. (1969). Neues Jahrb. Mineral.Abhand. Ill, 227.Oftedal, I. (1928). Z. Physik. Chem,(Leipzig) 134, 301.1.55211.52631.47491.39281.33741.23141.19421.17991.17051.14691.10691.10501.07781.05341.03701.02080.9909.9832.9454.9385.9285.9121.9015.8762.8715.8669.8571.8400.8393484562215755

Vanadium, VSampleHigh-purity electrolytic vanadium crystals were obtained from the U.S. Bureauof Mines. The sample shipped in argonhad the following Bureau of Mines analysis : aluminumcarbonchromiumcopper10 ppm16

Zinc Chromium Oxide, ZnCr 20 4SampleEquimolar amounts of ZnO and Cr2 O 3 weremixed, pressed into pellets and heatedto 900 °C for two hours. The pelletswere ground, and reheated to sharpen thepattern.ColorLight olive grayStructureCubic, Fd3m (227),[Passerini, 1929].Z=8, spinel type,d (A)4.8072.9472.5112.4052.0831.9111.69961.60251.47191.40840Internal standard Ag, a = 4.08641 ACuKfll A = 1.54056 A; temp. 25 °CI64510071621335402hkl1112203112224003314225114405312e(*)18.4430.3035.7337.3643.4147.5353.9057.4663.1166.31Lattice constantsNBS, sample at 25 °C -—————_Density(calculated) 5.367 g/cm 3 at 25° C.Reference intensityI/I , - 4.0' corundum ""a(A)O *5 *7 c8±.00011.31681.27011.25581.20231.16641.11281.08401.0409.9814.9616.9552.9310.8877.8730.849951043261254833371062053362244471164273180082275166284066493184471.6074.6775.6779.6882.6687.6190.5795.46103.42106.46107.49111.66120.39123.85130.01Additional patterns1. PDF card 21-1476[Kohlmuller and Omaly1968] .2. PDF card 1-1123 [New Jersey Zinc Co.New Palmerton, Pa.].8370.8165.8050.8013239493310-2-095110-2-2133.93141.24146.22148.00ReferencesKohlmuller, R.,and J. Omaly (1968). Bull,Soc. Chim. France 1968, 4383.Passerini, L. (1929). Atti reale accad.nazl. Lincei 9, 338.59

Zinc Iron Oxide (franklinite), ZnFe 2 0 4SampleThe sample was prepared by co-precipitation of the hydroxides, followed byheating at 600 °C for 17 hours and onehour at 800 °c.d(A)oInternal standard Ag, a = 4.08641 ACuK fll A= 1.54056 A; temp. 25 °CIhkl2e(°)ColorMedium brownOptical dataIsotropic, N>2.00StructureCubic, Fd3m (227), Z=8, spinel type,[Posnjak, 1930].4.8732.9842.5432.4362.1091.9371.7231.6241.4911.4270135100617

Aluminum Chloride, AICI 3StructureMonoclinic, C2/m (12), z=4. The structure was determined by Ketelaar et al.[1947] .Lattice parametersa=5. 9.3+0.02, b=10 . 24±0 .04 , c-6.l7tO.02A,[ibid.]Density(calculated) 2.49 g/cm3Thermal parametersIsotropic, overall B = 2.0Atomic positionsThose -used were the arrangement designated as the "ionic structure" [Ketelaaret al. , 1947] .Scattering factorsAl°, Cl° [3.3.1A]d(A)1.9561.0P91.9221.9071.8^51.8361.7871.7771.7601.7101.7071.6791.6471.6381.5171.5061.4P41.4751.4711.467/1?1167>1110IB2n201^4213334hkl0030 «4 21 3 2-203? 4 0-3 1 2-2232 P 2 *-133-3 3 1060222330-3 3 2 +133-? o **331062-3?300426(°)A - L54056 A46.3847.0847.2647.6647.9649.6051.0851.3851 .9053.5453.6654.6255. 7R56.1061 .0461.5462.5262.9663.1463.34Scale factor(integrated intensities) 1.811 x 10^Additional patterns1. PDF card 1-1133[HanawaIt et al.,1938]2. Laschkarew [1930]Calculated Pattern (Peak heights)1.4601.4201.4151.4101 .U041.4001.2*41.2721.2311.22331p4Sq11312 6 0 +-421203

AhMinum Chloride, AICI 3 - continuedd(A)5.575,5?4.944.413.863.362.932.922.P22.892.822.802.4622.4452.2072.0641.9561.9291.9?51.9221.9071.6Q51.B361.7P71.7771.7741.7611.7101.7071.7031.6791.6471.6391.6381.5171.5061.4fi41.4751.4711.4671*4601.4591.4211.4151.4101.4041*4021*4001*3791.2B4Calculated Pattern (Integrated)/Q^in171052295113057100431?1211?71o112?2?241?112332133343213561911hkl0010201 1 0-1 1 10211 1 1002130-201-112200-1311 3 1-202-2 P 22210 0 30421 5 0I 3 2-203240-3 1 2-223202151-133-3310602 4 1222330061-332133-204331062-333004260-402-421203400-134-171-262-3524012 enA = 1. 54056 A15,0017.3117.9420.10?3.0*26.5?30. 4U30.5930.6130.9?31.7031.9536.4736.7?40.5*43, 3P46. 3P47.0747.1747.2647.6647.9849.6151.0751.3751.4551.8953.5353.6653.7854.6?55.7ft56.0756.1261.0461,5362.5?62.9^63.1563.3563. 6R63.7465.6765.9466*2366*5466. 6R66.7967.8973.7462d(A)l.?721.2341.2311.2231.1741.1191.1131.1121.1091.1081.1081.0Q91.0R71.0B41.0R31.0K11.0331.02&1.0221,0191,003.9^5.994.988.9^6.972.967.963.923.915.913/p1522?1?I12p33311111ZẔ >1?.29P111hkl-2631 3 4262-404005333-5 3 1064-462-1 P 1-335263460191-533-4Q51 3 54611 Q 2-534531-193-464-602-391334065-3 3 6532-194-46528(°) 0A * 7.54056 A74.5677.2477.4778.1082.0486. 9PP7.6187.6487.9988.0788.1089.9990.2590.6190.7100. HS96.4097.3?97.8?Q8.21100,36101.40101,60102,4?102.73104.77105.60106.2?113.20114.63115.00ReferenceHanawalt, J.D., H.W. Rinn, and L.K. Frevel(1938). Ind. Eng. Chem. Anal.Ed.10, 457.Ketelaar, J.A.A., C.H.MacGillavry,and P.A.Renes (1947). Rec. Trav. Chim. 66, 501.Laschkarew, W.E. (1930). Z. Anorg. u. allgem.Chenu 193, 270.

Barium Oxide, BaOStructureCubic, Fm3m (225), Z=4 [Gerlach, 1922]Lattice parametersa=5.5393A, (published value: a=5.53912±0.00013A)[Zollweg, 1955]Density(calculated) 5.992 g/cm3Thermal parametersOverall temperature factor, 1.0Scattering factorsBa+a [Cromer and Waber, 1965]O [Suzuki, 1960]Scale factor[integrated intensities] 6.438 x 104d(A)3.19742.76931.95851.67041.59891.3m*71.270ft1.23871.13071.0650.9792.9364.9?3?_• P^75B.R44?.8351.7996Calculated Pattern (Peak heights)/100864 :1321'4Sin12M6^hs4$41hkl1 1 1200? ? 03 1 12224003 3 14 ? 0422511 +440531442 +6205 3 36 ? 244426(°) oA = 1.54056 A27.8832.3046.3254.92S7.6067.6074.6276. °085. RB9?.54103.74110.70113.10123.16131. 52134.5614^.90Additional patterns1. PDF 1-746 [Hanawalt et al., 1938]ReferenceCromer, D.T. and J. T. Waber (1965). ActaCryst. 18, 104.Gerlach, W. (1922). Z. Physik 9, 184.Hanawalt, J.D., H.W. Rinn, and L.K. Frevel(1938). Ind. Eng. Chem. Anal. Ed.10,457.Suzuki, T. (1960). Acta Cryst. 13, 279.Zollweg, R.J. (1955). Phys.Rev.100 #2,671.d(A)3.19B12.76971.95841.67021.59911.38481.270H1.23861.13071.0660Calculated Pattern (Integrated)7ion R"?5543IBR1620159hkl1 1 12002203112224003314 2 04225112 BOX = 1.54056 A27.8732.3046.3?54.9357.5967.5974.6276.9185. 8P92.531.0660.9792.9363.9232.92323514?.1033344053160044292.53103.74110.71113. in113.10.8758.8447.8351.79951031156205336224 4

Beryllium, alpha, BeStructureHexagonal, Z=2, isostructural with magnesium [McKeehan, 1922], P63 /mmc (194)[Neuberger, 1932].d(A)Calculated Pattern (Peak heights)/hkl26(°)A = 1.54056 ALattice parametersa= 2.2859 ±.0002, c= 3.5844±.0003A,(published values: a=2.2858 ±.0002, c=3.5843±.00031) [McKay and Hill, 1963].1.97951.79251.73301.32B71.14303025100QQ1000021 0 1i n 21 1 045. RO50.9052.7870.6684.74Density(calculated) 1.845 g/cm3Thermal parametersIsotropic, overall B = 2.01.0230.9*98.9636.9541.P961.8664.B163P1•\^111I 0 32001 1 2? n in o 4? n 210497.70102.20106.14107.68118.54125.50141.32PolymorphismA second hexagonal modification of beryllium exists. It has different alloying properties and a volume 29% largerthan the one described here [Sidhu andHenry, 1950].Scattering factorsBe0 [3.3.1A]Scale factor(integrated intensities) 5.998Additional patterns1. PDF card l-1291[Hanawalt et al.,1938]2. Jaeger and Zanstra [1933]ReferenceHanawalt, J.D., H.W. Rinn, and L.K. Frevel(1938). Ind. Eng. Chem. Anal.Ed.10, 457.Jaeger, P.M. and J.E, Zanstra(1933). Proc.Acad. Sci. Amsterdam 36, 636.McKay, K.J.H. and N.A. Hill(1963). J.Nucl.Materials 8, 263.McKeehan, L.W. (1922). Proc.Natl.Acad.Sci.US 8, 270.Neuberger, M.C.(1932). Z. Phys. Chem. Bl7,285.Sidhu, S.S. and C.O. Henry(1950). J. Appl.Phys. 21, 1036.d(A)1.97971.79221.73291.32B61.14291.0229.9898.9637.9541.8961.8665.8164Calculated Pattern (Integrated)/?. f]25100111?12P14in?1000021 0 11 0 21 1 01 0 32 n o1 1 22010043 •^hkl20210426C)\ = 1.54056 A45. AO50.9152. 7R70. 87R4.7497.70102.1°1 06.13107.67118.54125.50141.3164

Beryllium Lanthanum Oxide, Be 2 La 20 5StructureMonoclinic, C2/c (15), Z=4 [ Harris andYakel, 1968]Lattice parametersa= 7.5356 ± 0.0006, b= 7.3476 ± 0.0017,c= 7.4387 ± 0.00061, 3- 91°33'+1'[ibid.]Density(calculated) 6.061 g/cm3 [ibid.]Thermal parametersIsotropic: La 0.414Be 0.4120(1) 0.5640(2) 0.4800(3) 0.4040(4) 0.666Scattering factorsLa3 * [Cromer and Waber, 1965], correctedfor dispersion using Af'=2.6, Af"=9.2Be2 * [Cromer and Waber]O" [3.3.1A]Scale factor(integrated intensities) 11.38 x 10 4Additional patterns1. Weir and Van Valkenburg [1960].ReferenceCromer, D.T. and J.T. Waber (1965). ActaCryst. 18, 104.Harris, L.A. and H.L. Yakel (1968). ActaCryst. B24, 672.Weir, C.E. and A. Van Valkenburg [I960],J. Res. Natl. Bur. Std. 64A, 105.d(A)5.2604.2553.7873.7173.6753.2923.0643.0092.682,2.6302.6122.4942.4652.3762.2592.2272.2202.1662.1232.0542.026l. Q *01.9671.8831.6591.R371.8211.78341.76341.74221.73791 .70431.69901.6P3B1.69031.68571.67611.66211.65in1.64671.64341.62631.61591.60761.59741.57451.54201.531R1.51541.5021Calculated Pattern (Peak heights)/ ^26 -2 42 +p 2 M 2?1 1 041 1 1ion 20054 73 002020210 P 13

Beryllium Lanthanum Oxide, Be ? La ?0, - continuedd(A)1.48271.475°1.45891.44631.44311.41891.41471.40411.38161.36651.35961.34131 .31491.3067l.?P901.2 Q 071.28771.2^411.27551.26361.25991.25821.25531.24921.24721.24391.24041.21151.20841.20491.20131.19931.19611.1P801.17791.17431.17101.16801.15211.14921.14501.141?1.14021.13711.13541.12901.12301.11291.11051.10797836IS9431317?s15.">5?1554565r>?'474

Beryllium Lanthanum Oxide, Be 2 La 2 0 5 - continuedd(A)/WH2enA = 1.54056 Ad(A)Ifcfef26(°)X = 1.54056 A1.57441.5Ul«1.53171.51561 .51427132 (\5332-422-? P 4-24242258. 5*^9.9560.3*61.0°61.151.170*1.16791.15201 . 15041.1491^•?716-4 4 3206-261-533261^2.2^*2.5?*3.9?R4.06»4. 191.50231.48261.47591.47581.4589p121pQ242-3 1 45 1 0043-13461 .6962.6062.9?62. 9?63.741.14491.14241 .14121 .14011.13673?7u1-335-1545 1 4-6221 5 4R4.5784. 7^R4.9H85. OnR5.321.44711.44631.44431.41881.4146in162.5p1 '4^1343 1 4-3333331 5 164.3264.3664.4665.7665.9P1.13541.12901.12371.12331.12294^£.3p5-353533335622353R5.44R6.04R6.5^86.58R6.631 .40411.38171.36661.35941.34241 .34131.31501.30661.29911.290711P3q173-4?3-2 4 32 4 35 1 21 5 2-4044400 u 4-44144166.5467.7768.6169.0370,0470. in71.7?72.2572.7373. 2«1.11301.11061.10871.09791.09791.09031 . OR751.08321.08221.0676171?143'4-113226-3 1 6262063-1361 3 b316-4 4 4-623-53487. 5^87.8388. OP89.11R9.ll89. on90.20H0.6 C,90.7692.361.2^771.2*321.27541 .26361.2599611R?pRu63-334530-3 1 5334-42473. 4R73. 7P74.3175.1275.381.06481.05741.05441.Q5371.05072o1117 1 0-263-354-604263Q2. 6893.5193. 8b93.9494. 3n1.25971.25821.25551 .24941 .2487531-135600-1531 3 575.3975.4975.6976.1276.1^1.04491.04111.03891.03811.03653oP

Calcium, CaStructureCubic, Fm3ro (225),Z=4. The structure wasdetermined by Hull [1921].Lattice parametersa = 5.5886 ± .0002A, (published value:a = 5.5884 ±.00021) [Bernstein and Smith1959].Density(calculated) 1.525 g/cm3Thermal parametersIsotropic, overall B=2.0Scattering factorsCa° [3.3.1A]Scale factor(integrated intensities) 0.9867 x 104d(A)3.22662.79431.97591.6*501.61331.39711.2B211.24971.24971.14081 .07551.C75S.3879.9447.9447.9314.BR36.R836. Q 523.S425Calculated Pattern (Integrated)7ion4S2*3033944S41133311^Phkl1 1 12002203 1 12224003 3 1420n 2 44225 1 13334405 3 11 3 54420 ? 66 2. 05336222e(°)A = /. 54056 A27.6232.0045.80S4.4H57.0466.9?73. B576.1176.11^4.94PI .4R91. 4R102.46109.26109.26111.5R121.32121.32129.33132. 2Hd(A)Calculated Pattern (Peak heights)/hkl2en oA = 1.54056 A.8066.7826.79261444447 1 1551145.46159.67159.673.22692.7^451.97541.6*51l.f>133ion 2323bl 1 12002203 1 12 ? 227.6232.0045.9054.4057.04Additional patterns1. PDF card 1-735 [Hanawalt et al.,1938]2. Hull [1921]1.3971l.?*2P1 .249Ri. 14081.0755.QPRQ.9446.^314.«B36.85??35^^31?111400^31420 +4 ? 2r^ 1 1 +440531 +442620 +53366.9273. B676.1084.9491.49102.46109.26111.5ft121 .32129.32ReferenceBernstein,B.T. and J.F. Smith (1959). ActaCryst. 12, 419.Hanawalt, J.D., H.W. Rinn, and L.K. Frevel(1938). Ind. Eng. Chem. Anal.Ed.10, 457.Hull, A.W. (1921). Phys. Rev. 17, 42..H425.782S1o6 ? 2711 +132.20159.6368

Cesium Beryllium Fluoride, CsBeF 3StructureOrthorhombic, Pnma (62), Z=4 [ Steinfinkand Brunton, 1968]Lattice parametersa=4.828±.002,b=6.004±.002,c=l2.794±.003A[ ibid..]Density(calculated) 3.55 g/cm3 [ibid.]Thermal parametersIsotropic: Cs 2.62F(l) 4.22F(2) 4.39Be 2.44PolymorphismBreusov, Novoselova, and Simanov [1958]described three phases, specifying thatthe beta phase occurred between 140 and360 °C. The material being describedhere was thought to be the beta form,[Steinfink and Brunton,1968]Scattering factorsBe2 *, F [Cromer and Waber,1965]Cs+ [ibid.], corrected for dispersion byAf'=-1.40 and Af"=7.75 [Cromer,1965]Scale factor(integrated intensities) 7.513 x 104Additional patterns1. PDF 17-323 (at 200Simanov,1959]D C). [Breusov andReferencesBreusov, O.N., A.V. Novoselova, and Yu.P.Simanov (1958). Dokl. Akad. Nauk. S.S.S.R. 118, 935.Breusov, O.N. and Yu. P. Simanov (1959).Russ. J. Inorg, Chem. 4, 1190.Cromer, D.T. (1965). Acta Cryst. 18, 17.Cromer, D.T. and J.T. Waber (1965). ActaCryst. 18, 104.Steinfink, H. and G.D. Brunton(1968). ActaCryst. B24, 807.d(A)5.4333.8543.6103.4773.2433.1973.0022.P222.6672.4142-. 36B2.2592.P392.2062.1*192.1?22.1162.J011.9941.9831.9781.9511.9271.6911.8291.B121.7461.7381 .6961.6351 .6221.5^61.5611.5431.5291.5181.5011.4991.4611.4491.4161.4111.3991.3851.359Calculated Pattern (Peak heights)/2*137ion643301713a165511843279'41310?1045A52I6.?2I432341'432241hklo j 11 0 21 1 1n 1 31 1 20040201 1 31 0 42001 2 22022 1 02 1 10240061 1 52 C 31242 j 3n 3 11 0 62 fi 42201 3 10330 1 70261 3 31 2 6224206 +3023112311080 u 01 3 53 1 32332 1 72261 4 232204420(°) QA = 1.54056 A16.3023.0624.642^.6027.4fl27.892Q.7431.6833.5837.22^7.9639.8840.2440.8841.2042.3642.7043.0245.4645.7245. R446.5247.1248.3449.8050.3252.2852.6054.0256.2056.7257.6259.1459.9060.4860.9861.7661 .8663.6664.2265.9066. 1866.8467.6069.061.3551.3501.3331.3301.3293?I331280372081 1 93 1 569.3069.6070.5870.8070.8669

Cesium Beryllium Fluoride, CsBeF, - continuedd(A)Ihkl26( c)A * 1.54056 Ad(A)Ihkl26DA = 1.54056 A1.2751.2481.1841.1811.1781.1601.1401.1291.1261.0601.0581.049.901.901d(A)5.4353.6543.6103.4773.2433.1993.0022.8212.6662.4142.3682.3542.2592.2402.2062.1892.1322.1162.1011.9941.9831.9771.9511.9271.8811.8301.8121.7481.7381.6961.6361.6221.5991t1?3111111111240331244326237 +1 5 14 1 34043 3 5 +155 +2 210 +3 1 91 5 93 b 5Calculated Pattern (Integrated)/243510064232IB144IS6211110R3311415321357in621R41hkl0 1 11 0 21 1 10 1 31 1 20040201 1 31042001 2 20 1 52022 1 02 1 10 2 40061 1 52031 2 42 1 30 3 11 0 62042201 3 10330 1 70261 3 31 ? 622400874.3676.2281. 3681.4281.6683.1884.9886.0286.3093.16Q3.4694.50117.52117.5428(*)A * 1.54056 A16.2923.0624.6425.6027. 4R27.8729.7431.6033.5837.2237.9638.2039.8840.2340.8741.2142.3542.7043.0245.4645.7?45.3546.5?47.1348.3449.7950.3252.2852.6054.0156. 1 Q56.7?57.59701.5981.5611.5431.5301.51B1.5101.5011.4991.4601.4491.4161.4111.3991.3851.3591.3551.3501.3331.3301.3291.2971.2791.2751.2481.1901.1B41.1811.1781.1761.1771.1601.1561.1431.1401.1301.1291.1271.1261.0821.0671.0611.0601.D581.0571.0491.0431.0321*005.993.984.969.960->?543135?5^235p4313311?11?.2i312111I131I11211111111112063023 1 12311083 1 20 i| 01 3 53 1 32332 1 72261 4 23220 q. 41280372081 1 93 1 53240 0 102 4 03 3 11 4 62443264 1 12370 2 101 5 10531 2 104 1 32 0 104041 3 93353421433281 5 52 2 104243 1 92532 1 11* 3 3* 1 71 2 121 6 23 5 157.6359.1559. P 960.4760. ^R61.3261.7^61.8663,6664.2?65.9166.1966. R367.6069.0769.3069. 6P70.5970.7970.8772.8974.0474.3676.2180.7131.1681.4?R1.6581.6781.7683.17R3.5P84.7084. 9Q85.9186.0?86.2486.3190. 8HQ2.3R93.09P3.1693.4693.5794.4995.27Q6.53100.14101.69103.09105.37\06.76

Hydrogen Borate, beta, HB0 2StructureMonoclinic, P2 l /a(14),Z=12 [Zachariasen,1963].Lattice parametersa=7.122±.002,b=8.842±.002,c=6.771±.002A,3=93.26±.01° [ibid.]Density(calculated) 2.051 g/cm3 [ibid.]Thermal parametersIsotropic: B TB 11H .VIIIIII0.721.060.981.010.891.111.091.231.152.502.502.50PolymorphismThere are two other polymorphs of HBQs .One form is orthorhombic [Tazaki, 1940],and the other, cubic [Zachariasen,1963].PDF cards 9-15 and 15-403 appear to bethe orthorhombic form. PDF card 15-868contains the pattern of the cubic form.Scattering factorsBT , B°^ [McWeeny, 1951]O° [Berghuis et al.,1955]Scale factor(integrated intensities) 1.116 x 104ReferenceBerghuis, J., IJ. M. Haanapel, M. Potters,B.O. Loopstra, C.H. MacGillavry, and A.L. Veenendaal (1955). Acta Cryst. 8,478.McWeeny, R. (1951). Acta Cryst. 13, 403.Tazaki,H.(1940). J.Sci.Hiroshima U.AlO,37.Zachariasen, W.H. (1963). Acta Cryst. 16,385.d(A)6.7535.5425.3684.3804.1953.5563.3243.2973.2413.2223.1573.0743.0272.9442.B312.7232.7012.6852.5502.5452.5242.4252.3P32.3012.2902.2112*2062.1902.1442*1282.1112.0252.0081.9581.9161.9071.B491.8161.8021*7951.7911.7781.7621.7171.7111.6961.6651.6S81.6521.622Calculated Pattern (Peak heights)/33I7221005 r>q10in3ion2i?7in1011912611?10P,1733221561310144321232133\hkln o 11 1 00 1 11 1 -11 1 12001 2 -12 3 01 2 12 0 -10 1 22012 1 -1t 1 -21 1 21300 3 10221 2 -21 3 -12 2 1 +2 1 -22022 1 23 1 00403 1 -122-21 3 -2? 3 114032-1023 +I 2 -323-2123 +312 +32-233-1241033400 +331133 +4 1 -1401* 1 11 5 131-3 +42-1260 QA « 7.54056 ^13.1015.9816.5020.2621.1625,0226,8027.0227.5027.662R.2429.0229,4930.3431.5832.8633,1433,3435.1635. ?435.5437.0437,7239.1239.3240.7840.8841.1842.1242.4442.8044,7245.1246.3247.4047.6449,2450.1450,6050.8250,9651,3651.8453.3253.5254,0455,1055.3655.5856.7071

HydrofM Borate, beta, HB02 - continuedd(A)/hkl20H 0A * 1.54056 Ad(A)/hkl20O QX= 1.S40S6A1.6171.6121.5971*5831.5381.5*1*1.4521.4481.4151.33271.29131.28831.22161.21851.1708I11121^?111211134040-21 1 *4214021 2 *42225-22 ? 41 6 -235220-51 6 -335-31 7 "256.9057.1057.635B.2260.1260.7264.0664.2665.9670.6273.2473.447B.187ft. 4282.282.1432.1282.1112.0252.0082.0051.9581.93.61.9081.9071.8491.8471.8181.5021.7953322147?12?11114513-22 3 114032-10231411 2 -323-22 1 -31 2 33 1 233032-233-124142.1342.4442.8044.7245.1245. IP46.3347,4047.6247.6549.2449. 3PSO. 1350.6150,83d(A)6.7f>05.5415.3704.4214. 3824.1953.5553.3253.2^93.?413.2233.1573.0753.0?B2.9442.9302.7232.7022.6B52.5SO2.5452.5252.5222.4262.3*32.3012.2R92.2112.2052.191Calculated Pattern (Integrated)/2S159993ion 1127in91021?171I510319hkl0011 1 00 ] 10?01 3 -11 1 1200I ? -12101 2 120-10 1 22 0 12 1 -11 1 -21 1 21 3 003102212-21 3 -1? 2 1? 0 -22 1 -22022123100 if 03 \ -1? 2 -22*r>A = 7.54056 /4°13. OP15. 9*16.4^20.07?0.2S21.16?5.0326. 7?7.0127.5027. 6S28.2429.0129.4730.3331.5832.8733.1333.3435.1635.2435.5335.5637.0337.7239.1239.3?40. 7940. 8P41.171.7^01.7781.7771.7621.7181.7161.7111.6961.6651.6581.6521.6521.6221.6171.6121.5971.5831.6361.5241.4521.4481.4151.33271.311?1.29151.28831.22161.21861.17871.17091.12671.09831I11222?132111111224111111211\1I0334001 4 23311 3 31504 1 -14014 1 11 5 13 1 -333-242-13*040-21 1 44?1402124* 2 225-22241 6 -225-3352? 0 -51 6 -335-360-117-20064 1 -5SO. 9751.3651. 3«SI. 8553. 2n53.3453.5254.0455,1055.3755,5955.5956.7056.9157.1157.6858,2360,1260,7264,0664.2865,9570,6?71,9573, ?373.4478,1878.4181.61B2.2786,?F»89,07

Magnesium Phosphate, alpha, M^P 20 7StructureMonoclinic, P2 X /c (14), [Calvo, 1967].Z is assumed to be 4, not 2, as given byCalvo[1967] .d(A)Calculated Pattern (Peak heights)7 hkl26(°)X c 1.54056 ALattice parametersa=6.891±.005, b=8.295±.005, c=9.072±.005A,p =113.0±.l° [ibid.]Density(calculated) 3.18 g/cm3 [ibid.]Thermal parametersIsotropic: Mg(l)Mg(2)P (1)P (2)O (1)0.260.330.170.130.380.320.370.310.570.146.425.09i*. 3674.1493.8643.8443.7143.^903.2133.0072.94(42.8382.6712.6392.6242.5*402.4342.1742.1002.07413316131341001?.11£>q5311?1 0 0-111-1020 ? 0-1 1 21 1 1021-121200-122 +022-1 1 3-2 2 10 1 30312 2 0 +1 ?. 2I -2 1 3 32 +310 +13.7817.4020.3221.4023.0023.1223.9425.5027.7429.6830.3431.5033.5233.9434.1435.3036.9041.5043.0443.60Atomic positionsThe atomic parameters given by Calvo[1967] are for a related non-primitivespace group setting B2i /c . Those parameters were converted by a matrix to thecorresponding values for P2!/c,to facilitate computer calculations.PolymorphismA high-temperature polymorph, 3-MgsP2 O7/has the thortveitite structure. Thetransition occurs at 68 °C,with apparentcoexistence of both a. and 6 phases overan extended temperature interval.[ibid.]Scattering factorsMg"1" 2 , P° , O" 1 [3.3.1A]Scale factor(integrated intensities) 2.543 x 1042.0402.0162.0121.P731.8651.7301.7071.6^31.6411.6381.6271.6141.6071.5741.5411.5031.4761 .4711.4131.3^31.3*581.3531.3381.3351.325]213fj351P •51337?233?_21->1o4-133-322041-142024 +3211^2 +330223 +0 1 5051 +-4041^0 +-3343?2 +204 +-432 +0 14 4224060-1 u 52 U 3-5J4 +-511 +-235 +44.3844.9245.0248.564A.8052.8853.6454.1255. 9656.1256.5057.0257.3058. 5859.9661.666P.9263.1466.0867.726^.1269.3870.2870.5071.06Additional patterns1. PDF card 8-38 [Menary, African Explosives and Chemical Industries Ltd.,Transvaal, South Africa]1.3221.3181.2701.2561.2372112I234412510 +1 6 22 U 4 +71. ?B71 .5474.6875.667R.5473

Magnesium Phosphate, alpha, Mg 2 P 20 7 - continuedd(A)6.435.094.3664.1754.1473.R643.8453.7153.4R93.2133.0083.0073.0062.9^82.9962.9432.8382.6712.6392.6252.5422.5402.5402.4342.3052.2452.1P32.1742.1002.0992.0R82.0742.0742.0402.0162.0131.9741.9201.8731.8661.8651.7911.7511.7451.7301.7101.7081.7071.7071.698Calculated Pattern (Integrated)/367435I5p6in7?ion86141423U31^4131p1q2?9151241116416111715641hkl1 0 0-1 1 1-1020020?0-1 1 21 1 10?1-1 ? 1200-2 i 2-1221 0 21 2 1210022-1 1 3-? 2 10 l 3n 3 1-1312 P 01 3 01 2 2032? 2 1-1 1 41 1 3-2322 1 2OQ43 1 0040-1 3 3-3 P 2041-1 4 1231-1 4 2-3 1 4024104-1 3 4-4023 2 1-143-4121 4 2232-3332 enX = 7.54056 A13.7717.3920.3221. ?6PI. 4123.0023.11P3.9425.51P7.7429.67?9.6f>29.7029.7829.8030.3531.4933.5333.9434.1335. 2P,35.3135.3136.9039.0440.1441.3341.4943.0443.0643. 3n43.6043.6144. 3P44.9345.0145.9347. 2P48.5648.7648.8050.9652.2052.3952. R853.5653.6253.6553.6553.9574d (A)1.6931.6601.6481.6421.6411.6371.6281.6271.6141.607i.sns1.5741.5501.5421.5421.5421.5041.5031.4761.4761.4711.4521.4131.4021.3951.3911.3*31.3641.3581.3541.3391.3381.3361.3351.3261.326i.3?01.3191.3181.3121.2701.2701.2621.2561.2511.2381.2371.2181*2171.208/3I1p35239?52?2114114627251II61253?o3491112311h122221hkl330302-125-2432230 1 53 1 2051-4Q44001 5 0-334-3 P 5-342052322-? 4 4204-432-P 5 20444 1 12243 4 11 ? 5-5020600 6 1-145243-5 1 4-1541 5 3-5 1 1-4 1 6-2362340 ? 64123505 1 02601061 6 2-1 1 7063-227-534244-50620(°)A = 7.54056 A54.1255.2^55.7?55.9756.0056.1356.4756.5157.0157.3057.3158. 5P59. 5059.9359.9559.9661.6?61.6762.^?62.9463.1464. in66.0766.6467.0?67.2767.7?68.7769.1369.3770.2670.3170.4?70.5171.0371.0671. 3871.4371.5471.9374.6774.6875.2375.6576.0476.9477.0478.4878.5479.20ReferenceCalvo, C. (1967). Acta Cryst. 23, 289.

Manganese Vanadium Oxide, Mn 2V2 07StructureMonoclinic, C2/m (12), Z=2. The structure was determined by Dorm and Marinder[1967].Lattice parametersa=6.710±,002 f b=8.726±.002,c=4.970±.OOlA f3=103.57±.01° [ibid.]Density(calculated) 3.801 g/cmsThermal parametersIsotropic [ibid.]Scattering factorsMn°,, 0" 1 [3.3.1A]Scale factor(integrated intensities) 2.738 x 104Additional patterns1. Brisi [1958]ReferenceBrisi, C. (1958). Ann. Chim. (Rome)48,270.Dorm, E. and B. Marinder (1967). ActaChem. Scand. 21, 590.d(A)5.2214. K?84*3623.9353.P553.2383.0562.6562.6122.4492.42B2.4162.3632.2392.2052.1P-12.1362.1192.1122.0511.9^91.9671.8061.7901.7761.7541.7471.7421.7081.6R61.6311.6271.6231.6191.6101.6011.5621.5591.5501.5481.5261.5031.46341.45441.45031.43951.43561.42351.37221.3634Calculated Pattern (Peak heights)/ hkl8 -1336 3123 -1523 4214 -351171 1 01 0016 0 P 0r> -1 1 153 111 +ion n 2 14"-J-P 0 1111 3 0l n 2206 2 n 14 ^ -131Oo25 -1 1 21 1 3 14 -2024 0 n 01 ? ?. 1IS -311in 310 +21 1 26 0

Manganese Vanadium Oxide, Mn 2V 20 7 - continuedd(A)1.36061.32551.31331.26851.266P1.25451.25141.23061.22851.22501.1^961.19021.3 8001.161*11.13071.12401.11781.09341.08521.07331.07191.06871.06401.06141.05931.05491.05361.03441.03231.02991.0113.9*73.9R3P.977h.3673.9663.9371.932R.9263.9129.9096.9013.R939/3132.21?1?_111113?-.I3411?11?\->o•>?-;>'„}111111?I11hkl350203 +-261223-5 1 2-423-442 +-204-114402-1715305 1 10241 5 3-3533 5 2 +-334460 +-533 +-244-4240 8 1 +1 3 4-6226 P 0 +-462280-552 +3 7 1-154S 3 25 5 1-2 8 2-225005 +-135-4 0 52 B 2 +-4 B 1-731 +-2 9 3 +-7 1 326(«)A - 1.54056 A68.9671.0671. B274.7874.9075.7675.9877.5077.6677.9279.9080.6681.5082. R685.8886.5287.1289.5890.4491.7291.889?, 2492.7693.0693.3093.8093.9696.2696.5296. R299.22102.56103.06103.98105.56105.72110.56111.34112.52115.08115.74117.44117,94d(A)5.2244.8314.3633.9353.2613.2553.2383.0562.6572.6122.4502.4282.4162.3692.2392.2042.1812.1362.1182.1132.1102.0511.9831.9671.8061.7901.7761.7541.7461.74.11.7081.6R61.6311.6291.6281.6231.6191.6101.6011.5631.5581.5581.5511.5481.5281.5031.46351.45431.44911.4395Calculated Pattern (Integrated)I15162I49100521?217436in651IB1•*37171355352541"!1311?29127p63457p11hkl1 1 0001020-1 1 12001 1 1021-2 0 11 3 0220201-1 3 1002-1 1 2131-2020402 2 1-3 1 10223 1 01 1 2041-222-3 1 23 1 1-2 4 1202-3 3 13 3 01 3 2150400241222-151042003-2 0 31 5 1-332-4 2 1-2423 3 1-402-2231 1 3060-3 1 3-1332 BOX = 1.54056 A16.9618.3520.3422. 5RP7.3227.3827.5229.2033.7134,3036.6537.0037.1937.9540.2440.9141.3542. ?«42.6542.7542.8?44.1345.5946. in50.5050. 9P51.4?52. 0°52.3552.5053.6?54.3756. 3P56. 4?56.4056.6^56.8?57.1557.5359.0759,2459.2559. 5^59.6860.5461.6763.5?63.9664.2264.7076

Manganese Vanadium Oxide, Mn 2V 20 7 - continuedd(A)1.43531.42361.37231.36331.36101.32561.32511.31321.26851.26671.25441.25151.25061.23061.2235 -1.2P4B1.20511.19951.19031.1B01I355S31152??212311233£&;3 1 2-1524 ? 1-3 5 1350203-4 LI 1-2 6 1223-5 1 2-423-442261-204-1 1 44 Q 2441-1715305 1 126(°)X = J. 54056 A64.9165.5168.2968. Bl68.9471.0471. OB71. B374. 7B74.9075.7775.9776.0477.5077.6677.9479.4679.90BO. 6581.49d (A).9673.9663.9657.9391*.9373.9326.9265.9263.9152.9143.9129.9096.9092.9014.9013.9006.8989/2?11.1211113?121-225005-3 1 5-264-135-4057 1 02 8 2334602-4 8 1-7 3 15 1 3-2 ft 3570-732-7 1 311hkl20O oA = 1.54056 A105.56105.7?105.821 10.161 10.5411 1.34112.47112.5?114.63114. BO115. OP115.73115.82117,42117. 4S117. SP117. 9S1.164H1.13081.12411.11961.1183?4.3120?41 5 3-3 5 3262-60182. B685. SR86.5186.9487.071.11761.09331.0B541.0B511.07334p336352-334460333-53387.1489. 5RQ0.4290. 4S91.721.07321.071B1.06851.06401.063421P411 7 2-2 4 4-^240 R 1-55191*7391.8992. 2S92.7792. 831.06191.059?1.0S491.05491.0535121211 3 4-6 ? 22 0 4620-462^3.00^3.31^3.8193.83Q3.971.03441.03301.03231.03001.0113313?32 B 0-372-5523 7 1-154c»6.2696.4396.5?06.8199.2?1.0059.9961.9872.9838.977611432-5 1 4-173532^51-2 B 299.96101.31102.571.03.07103.9877

Methanesulfonanilide, C 6 H 5-NH-S0 2CH 3StructureMonoclinic, P2 X /c (14), Z=4 (King,1968]Lattice parametersa=9.203±.007,b=8.2!7±.005,c=11.026±.006A3-103.71°±.06° [ibid.]Density(calculated) 1.41 g/cm3 [ibid.]Thermal parametersIsotropic: H(12) through H(20) [ibid.]3.000(2) 4.170(3) 4.38N(4) 3.29C(5) 4.58C(6) 2.93C(7) 3.98C(8) 4.48C(9) 4.52C(10) 4.66C(ll) 3.91Scattering factorsN° , 0° [3.3.1A]C° [Berghuis et al.,1955]S° [Dawson, 1960]H° [Stewart et al. , 1965]Scale factor(Integrated intensities) 2.385 x 104ReferenceBerghuis, J., IJ. M. Haanapel, M. Potters,B.O. Loopstra, C.H. MacGillavry, and A.L. Veenendaal (1955). Acta Cryst. 8,478.Dawson, B. (1960). Acta Cryst. 13, 403.Klug, H.P. (1968). Acta Cryst. B24, 792.Stewart, R.F., E.R.Davidson, and W.T.Simpson(1965). J. Chenu Phys. 42, 3175.d(A)8.^36.S?6.055.675.365,1634.9404.4854.4714.3714. IRQ4.1073.9263.8343.7323.6393.5373.4223.3173.2593.0423.0252.9662.P932.R792.8722. 8362.8012.7962.7462.7192.6772.6542.6082.5462.4902.4642.4572.4202.4122.3762.3352.2822.2782.2622.2442.2352.1952.1852.180Calculated Pattern (Peak heights)/11215241004552629992?485592?17551530^~jI21?3410121191163275223255124222fcfeZ1000 1 11 1 0-1 ] 1002-1021 1 10 ] 2200-1 1 21020 ? 0? 1 0 +0211 ? 0 +-1 ? 1-2 1 21 2 1-1 1 3022-? 2 12 ? 0-2 1 32121 1 3-3 1 1-2223 1 0221-3 1 2-1230040 3 1-1 1 4014-3 1 3-214 +-3 2 1-132320302230312 +-3 0 ^3 2 1024 +400-3 1 4-133-4122BC) oA = 1.54056 A9.9013.5814.6415.6216.5417.1617.9419.7819. R420.3021.24?1.6222.6223.1823.8224.4425.1626.0226.8627.3429.3429.5030.1030.8831.0431.1231.5231.9231.9832.5332.9233.4433.7434,3635.2236.0436.4436.5437.1237,2437.8438.5239.4639.5239.8240.1640.3241.0841.2841.3378

Methanesulfonanilide, C 6 H 5-NH-S0 2 CH 3 - continuedr ! d (A)2.1452.0422.0252.0171.99b1.9251 . 9 0 B1.3671.8631.P421.3191.B091.7Q21.7871.7701.7511.7451.7711.6*51.6401.6081.SR71.5111.4581.4511.4361.4321.3761.373/1113 '}11^:>\3!4324p0o113111I111hkl223-3312143 3 0 -H"3321 1 54022 4 0421•< 2 3-2422 ti 1-1 1 6-143 +-? 1 6-334 +-4 3 24 ? 2 +-3 1 6^20-? 4 45 0 2-236-336252-622-352-4363 1 626( c)A = 7.54056 A42.1044.3244.7244.9045.4047. IB47.6248.74'48.8449.4450.1050.405H.9251.0651.5052.1852.4052.8454.4056.0457.2658.0861.2863.8064.1264.9065. 1068.1068.24d(A)8.946.S26.055.675.365.1664.9404.4874.1*704.?734.1794.1093.Q273.9193.5363.7333.7253.6393.5373.4223.3173.2603.0423.0252.9672.8932.e*o2.8722.8362.B02Calculated Pattern (Integrated)/q1^474914?521IBion2?47563r>2151*55IS32^11*>1?3^^31*0331.1231.5?31.922.7962.7472.7182.6782.654Q1\101221-3 1 2-12300403131. 9R32.5732.9?33.4?33.752*6092.5462.4902.4642.462193o71-1 1 40 1 4-3 1 3-2141 ? 334.3535.2236.0436.4?36.472*4572.4202.4122.3762.33512142-3 2 1-13232030223036.5537.1237.2437. 8338.522.2R62.2822.2782.2622.2452u311-1243 1 2-3043 2 1-23239. 3Q39.4539.5239.6140.1379

Methanesulfonanilide, C CH 5-NH-S0 2 CH 3 - continuedd(A)/hkl20(°)X = 1.54056 A2.2132.2352.1^62.1*52.1B1?4p?10 ? 44 n o-3 1 4-1 3 3-4 1 240.1640.3?41. OP41.2*41.362.1452.0422.02b2.0172.0171.9961.9631.^411.9?5l.POB21I13P111I223-3312 1 4041330-3324 ? 0-1 1 3 1 *540242.1044. 3P44. 7244.8944.9145.4046.2046.7647.1847*611.9671.8641.8421,8191.B091.7921.7871.7851.7701.7522113141195240421323-2422 q 1-1 1 6-1 u 3006-2 1 6-33448.7448.8349.4550.0950.4150.9151.0651.1251.5952. 1*1.7511.7441.7321.7311.6*51o1123 1 4-4 ? 2430422-3 1 652.2052.42S2.8P52. 8654.301.6401.6081.5A71.5421.5121,o1115 ? 0-? u 4502250-2 3 656.0457*2558. 0*59.9?61.271.4581.4511.4391.4361.4311.3761.373p111111-3 3 6252350-622-352-4363 1 663. 7164.1364.7?64.8965.1168.1068.2480

Nickel Chloride, NiCUStructureHexagonal, R32 (155) or R3m (166), Z = 3(hexagonal cell) [Pauling, 1929]. Thestructure was refined and the spacegroup determined as R3m by Ferrari etal., [1963].Lattice parametersa= 3.478 ±.001, c= 17.41 ±.12 [Ferrariet al., 1963].Density(calculated) 3.540 g/Cm3Thermal parametersIsotropic, overall B = 2.0Scattering factorsCl° [3.3.1A]Ni° [3. 3. IB]Scale factor(integrated intensities) 1.668 x 104Additional patterns1. PDF card 1-1134[Hanawalt et al.,1938]ReferenceFerrari, A., A. Braibanti and G. Bigliardi(1963). Acta Cryst. 16, 846.Hanawalt, J.D., H.W. Rinn, and L.K. Frevel(1938). Ind. Eng. Chem. Anal.Ed.10, 457.Pauling, L. (1929). Proc.Natl. Acad.Sci.0S15, 709.d(A)5.602.972.4R2.281.931.921.761.711.671.501.451.421.401.3?1.2 Q1.291.241.141.11I.JO1.091.04I.n21.011.00.965.826.S20.7R7Calculated Pattern (Peak heights)/ion3079P1101*178?2631113133111211111hkl0031 0 11040 1 5OQ91 0 70 1 B1 1 01 1 30210 0 120 ? 40 1 112051 1 90272082 1 11 1 122 1 42 n 112171 0 161283001 1 153 0 12 +1 3 42 1 1626(°)A = 1. 54056 A15.2630. OB36.2439.5246.9447.3651.7852.5855. 0361.7864.1465.5466.7067.7473.1273.4476.9285.3887.483B.7689. R296.1697.6499,56100.20105.86137. R2139.74156.6281

Nickel Phosphide, Ni 12 P 5StructureTetragonal, I4/m (87),Z=2 [Rundqvist andLarsson, 1959]Lattice parametersa=8.646, c=5.07ol [ibid.]Density(calculated) 7.53 g/cm3 [ibid]d(A)4,37'4.3?3.073.0562.735Calculated Pattern (Peak heights)I433316hkl0 1 1020? 1 1 +-> ? o3 1 026C)A = 7.54056 A.20.30?0.5H29.0229.2032.72Thermal parametersOverall temperature factor, 0.49 [ibid.]Scattering factorsNi° [Thomas and Umeda, 1957]P° [Tomiie and Stam, 1958]Scale factor[integrated intensities] 13.389 x 104ReferenceRundqvist, S. and E. Larsson (1959). ActaChem. Scan. 13/ 551.Thomas, L.H. and K. Umeda(1957). J. Chem.Phys. 26, 293.Tomiie, Y. and C.H.Stam (1958). Acta Cryst.11, 126.2.5352.5052.3412.1«62.3672.1622.0381.9331.B591.6961.6451.6361.5881.5371.5311.4581.4091.3811.3671.3161.3051.2601.2681.2531.2492q42182?33206 rj10073P,572123u11o7110020311 J 20222 3 1 +040330? 4 0 +3 1 25 1 0042051 +332? 4 2 +? 5 1033512 +2336201 4 3541352 +0040623 6 135.3835. P23R.4241.2641.6441.7444.4246. 9b48.9654.0455. B656.1658.0260.1460.4263.8066.2667. 7868.6071.6672.3674,0074.8475,3876.141.2231.2091.2031.2001.150621171710 +053 +262 +640 +3 1 47P.1079.1879.6079. 8B84.121.1351.1011.0931.0841.0B1?.103 LV4370552 +044642651 +85.4688.768^.5890.5690.841.0761.0601.0491.0151.005310421334244 +K 1 1 +514570PI. 4093.2294.4698.70100.0683.969.967.955.934.929331222 B 24 A 0 +1 9 0572 +624105,32105.68107.56111.08111,94

Nickel Phosphide, Ni I2 P 5 - continuedd(A).926.922.911.905.880.875.871.865.846.840.837.820.818.807.805.804.803.797.790.788.783/111341?12IJ1364714123hkl6537619309 1 3 *714 +0556444 9 1 *374950 +116763 +682 +3 1 658310 g 2 +4 10 0952 +6 Q 1 +5741 11 020OA = 7.54056 A112.56113.30115. 3B116.5812?. 16123.44124.34125.96131.24133.06133.92139.90140.54145.16146.08146.66147.32150.16154.62155.96159.50d(A)4.374.323.073.0753.0572.7342.5352.5052.3422.1872.1682.1682.1622.0381.9781.9331.9331.8591.6961.645Calculated Pattern (Integrated)/3221o14184017216?3197hkl0 1 10202 1 11 2 12203100020311120223 2 12310 4 03301 4 1420? 4 03 1 25 1 004220OA = 1.54056 A20.2920.5?29.0229.0229.1932.7^35.3835.8138.4141.2541.6341.6341.7544.4246.8546.9646.9648.9654.0455,851.6371.6371.6371.5881.53716431007'4"5?3314 3 13 4 10 5 13324?256.1556.1556.1^58.0?60.141.5371.5311.4581.4091.409612?12422510335 1 21 5 260.1460.4363.7966.2666.261.3011.3671.3161.305l.PRO35 r>1?2336201 4 354153267. 7 B68. 5Q71.6672.3674.001.2801.2671.2531.2491.223A01143520 0 40623 6 17 1 074.0074.8575. 8^76.1478.101.2231.2231.2091.2091.209121115501 7 04333^305378.1078.1079.1879.1879. IB1.2031.2031.2001.1991.150691316222620716403 1 479.6179.6179.8679.9584.1184

Nickel Phosphide, Ni 12 P 5 - continuedd(A)/hkl20( e)A = 1.54056 Ad(A)/hkl2enA = 1.54056 A1.1351.1011.1011.1011.093363543705527 1 21720 4 14.85.4588.7688.7688.7689.58.808.807.806.804.804?1>111482843 1 65 " 310 2 22 10 2144.89145.15145.9?146.68146. 6B1.0841.0821.0821.0761.0605214 '46 t| 26 5 15 6 133442490.5890.83QQ.8391.4093.22.803.7^7.7^7.797.79411111?4 10 0592952365664147.29150.15150.1^150.2^151.841.0601.0491.0491.0491.0151123132 7619308 1 31 8 3743113.301.15.38116.57116.57116.57.894.880• 880• 6*0.675Ios2In i 21 7 7 1 4M-554055119.10122.16122.16122.16123.43.871.865.865»AU3.846321146 4 44 Q 186010 2 0374124.34125.87125.98130.61131.25.840.840.837.829.826213119505 Q 01 1 6026772133.05133.05133.92136.50137.76.820.820.818.818.8181I15?2 P 37638626820 10 21 39.89139.89140.54140.54140.5485

Phosphorus Oxide (stable form I), P 20 5 (orthorhombic)StructureOrthorhombic, Fdd2 (43), Z=Q. The structure was determined by de Decker [1941].Lattice parametersa = 16.3, b = 8.14, c = 5.26 A [ibid.]Density(calculated) 2.70 g/cm3 [ibid.]Thermal parametersIsotropic, overall B = 2.0Polymorphismde Decker and MacGillavry [1941] described a metastable rhombohedral formhaving the space group R3c (161). Hill,Faust, and Hendricks [1-943] identified athird phase which was thought to be tetragonal but was later shown to be adifferent orthorhombic phase »with spacegroup Pnam (62) [MacGillavry et al.,1949].d(A)4.264.073.f^3.432.882.622.392.212. 062.041.9391.R891.8211.7051.6751.5171.4971.4431.4401.404Calculated Pattern (Peak heights)/ionic;1441207^1?R9p133 •5119hkli i i4 n o2203 1 14 ? 0S 1 11 3 10?27 1 1040 +531 +602R ? 0 +1 1 3^ 1 15 1 34

Phosphorus Oxide (stable form I), P 2 0 5 (orthorhombic) - continuedd(A)4.264.073.643.432.B82.622.392.?12.062.04Calculated Pattern (Integrated)/1009h154S24^Q11hkl1 1 1400? 2 03 1 14205 1 1131022711A 0 020(°)X = 1.54056 A?0.8121.7924.4325.9731.0334. 1537. 6R40.8?43. 9?44.43Referencede Decker, H.C.J. (1941). Rec. Trav. Chim.60, 413.de Decker, H. C. J. and C. H. MacGillavry(1941). Rec. Trav. Chim. 60, 153.Hill, W.L., G.T. Faust, and S.B. Hendricks(1943). J. Am. Chem. Soc. 65, 794.MacGillavry, C.H., H.C.J. de Decker, andL.M. Nijland (1949). Nature 164, 448.Thilo, E. and W. Wieker (1954). Z. anorg.u. allgem. Chem. 277, 27.2.031.9421.9391.8901.822249pp040422^31602^2044.4646.7446. 8248.1150.0?1.8211.7051.6761.5481.537114144 £+ 01 1 39111 5 15 1 350.0653.7354.73S9.6761.031.4981.4971.4481.4401.421174118 P 24 if 29 3 1^4033361.9061.9464.2764.6*65.631.4041.3421.3151.3121.272311?1551533004102210^066.5670.0571.7171.9374.531.2631.2061.2061.1961.190113p18 U 213 1 10624 2 41 5 375.1679.3779.4180.1780.691.1801.1431.120.924121195193355348281.5184.78R6.B7112.9187

Phosphorus Oxide (stable form II), P205 (orthorhombic)StructureOrthorhombic, Pnam (62), Z=4, The structure was determined by MacGillavry etal. [1949]. Using their data, Cruickshank[1964] performed a least squaresstructure refinement.Lattice parametersa= 9.23, b= 7.18, c= 4.94A [ibid.]Density(calculated) 2.880 g/cmaThermal parametersIsotropic, overall1964] .Atomic positionsCruickshank [1964]B=.55 [Cruickshank,PolymorphismTwo other forms are known. One is metastableand has the rhombohedral spacegroup R3c(161)[de Decker and MacGillavry1941]. The other is a different stableorthorhombic phase with space group Fdd2(43) [de Decker, 1941].Scattering factors0°, P° [3.3.1A]Scale factor(integrated intensities) 1.041 x 104Additional patterns1. PDF card 5-0488 [Hill et al., 1943].(incorrectly labelled "at 580 °C")2. Thilo and Wieker [1954]ReferenceCruickshank, D.W.J. (1964). Acta Cryst.17,677.de Decker, H.C.J. (1941). Rec. Trav. Chim.60, 413.de Decker, H. C. J. and C. H. MacGillavry(1941). Rec. Trav. Chim. 60, 153.Hill, W.L., G.T. Faust, and S.B. Hendricks(1943). J. Am. Chem. Soc. 65, 794.MacGillavry, C. H., H.C.J. de Decker, andL. M. Nijland (1949). Nature 164, 448.Thilo, E, and W. Wieker (1954). Z. anorg.u. allgem. Chem. 277, 27.d(A)5.674.614.073.883.723.593.373.052.832.772.472.452.342.312.262.182.152.122.112.102. OR2.011.9871.9411.8891.862i.sne1.7621.6971.6901.6861.6811.6731.6601.6421.6111.5841.5811.5741.5531.S501.5381.5261.5161.S041.4781.4691.4621.4521.423Calculated Pattern (Peak heights)/5541481465346100775351593133118426123441JLB1in.442R13123?37?P7162211hkl1 1 02000 1 12101 1 10202012 1 1220 +1 2 1002311 +3204001 1 22020 3 12303 2 11 3 12 1 24 1 11 2 2420330222421140 +3221 3 24025 1 12401 4 1520 +232? 4 11 1 34 3 15 ? 1340 +6004222 1 36 1 0123 +6015300 (* 23 1 32 en oA = 7.54056 A15.6219.2221.8222.9023.8824.7826.4029.2431.5432.2836.3436.5838,5039.0039.7841.4241.9042.5242.7843.1043.3845.1445.6246.7648.1248.8850.4851.8453.9854.2454.3654.5454.8455.3055.9657.1458.1358.3258.5859. ?659.5860.1060.6261.0861.6062.8463.2663.6064.0865.5488

Phosphorus Oxide (stable form II), P,0, (orthorhombic) - continuedd(A)1.4191.4171.4021.3851.3671.3641.3601.3561.3421.3171.3131.3061.2971.2851.2581.2551.2521.2351.2291.2?71.2391.1991.1871.1771.1741.1691.1661.1631.1541.1511.1481.1461.1411,1391.1371.1281.1251.3301.1071.1051.0981.0931.0921.0771.0751.0721.0341.0271.0191.017/1113574213q5114425531122111111312113311?1111?12131hkl150440531242522t 5 16210331 7 34 1 33426027 1 06 1 2532 +711 +6310044426224502521602142434330245238QO352712632542810641261 +731 +8317225518205^3 +3240621 5 36238 1 26517 1 363326(°)A * 7.54056 A65.7665.8666.6967.5868.5868.7869.0069.2070.0471.5671.8272.3072.8873.6875.5275.7675.9677.1877.6277.7678.3679.9680.9481 .7682.0482.4082.5482.9883.7684.0084.2684.4484.9085.1485.3286.1686.4687. 8B88.2288.4289.0689.6089.7491.3491.5691.8496.2697.2298.2498.42d(A)5.674.624.073.883.7?3.593.373.052.832.832.772.472.462.452.342.312.262. IB2.152.122.112. 102. OP2.011.9871.9411.8891.8621.8071.7641.7621.6971.6^01.6861.6811.6731.6601.6421.6421.6111.5851.5*11.5751.5581.5511.5501.5381.5261.5161.504Calculated Pattern (Integrated)/4736478424946100o1803641293143IP.942614445171?134t41Dt?13?2343623q1hkl1 1 0200Oil2 1 01 1 1n ? o2012 1 1? 2 03 1 01210022 2 13 1 13204001 1 22020312303211 3 12 1 2^ 1 1 P 124 ? 0330? ? 24 ? 13311 4 03 ? 21 3 2402511? 4 01 4 15204 3 2? 3 2241113^315 ? 12033406004222 1 36 1 020(°)A = 1.54056 A15.6219.2221.8222.8923.88?4.7*26.41P9.2331.5531.6332.2936. 3U36.5336. 5*38.5039.0039.7841.4341.9142.5142. 7P43.0943.3845.1345.6146.7648.1348. 8A50.4751.7751.8553.9854.2454.3654.54S4.8355.3155.9755.9757. 1458.1758.3058.5359.2659.5659. 5*60.1060.6?61.0861.6189

Phosphorus Oxide (stable form II), P70, (orthorhombic) - continuedd (A)/hkl20(°)A = ;. 54056 Ad(A)7hkl20( c )A = 1.54056 A1.4791.4771.4691.4621.452933323 M 11 2 36 0 153004262.7662.8563.2663.6064.071.1051.0981.0931.0931.0923211?551820452533324R8.4189.0689.5^89.6089.741.4231 .4191.4171.4021.3851i->243 1 31 5 04 4 05 3 124265.5465.7665. B766.6767.571.0771.0751.0731.0681.034231140621 5 3623234R 1 2PI. 3?Q1.5591.7992.3496.261.3671.3641.3591.3571.342672215221 5 16 2 10331 3 368. 5P68. 7&69.0369.1970.051.0271.0211.0191.0171.016P11116513537 1 363336297.2197.9S98.2398.4198.541.3181.3131.3061.2971.2854156I1«* 1 33426 n 27 1 06 1 271.5571.8?72.3072. 8R73.68.994.987.976.966.963211312 4 M-524462344604101.66102.61104.241 05.76106.231.2581.2561.2561.2541.25215P?p3515324237 1 163175.4975.5275.6875.7775.95.957.955.953.953.946??1122 1 53 7 17516431 2 5107.12107.57107.86107.90108.761.2351.2291.2271.2191.19938T(1200444262245025277.1777.6?77.767S.3779.96.947.946.943.937.9343o91p2637335348 1 3553108.79109.11109.40110.621 1 1 . 1 P1.1931.1871.1771.1741.169132.112041 6 02 1 424343380.4380.9481.7682.0582.40.931.930.913.901.900121p34445620354 1 51011til. 67111 .801 15.01117.49117. 6P1.1681.1631.1541.1511.148211II0245238003 5 27 1 282-5482.9983.7783.9984.26.899.894.693.890.8R6113118507 1 4180940760117.84118.92119,15119.77120.741.1461.1411.1391.1371.129p312163254281064134384.44R4.9085.0°R5.3286.06.885.676.868.856.847121416539414541 6 4525120.97123.04125.19128.36130.991.1281.1251.1241.1101.107431212 6 17 3 16038 1 172286.1686.46R6.5187.89B8.23.843.840.838.837.837223118041 8 2373814753132.03132.97133.70133.83134.0690

Phosphorus Oxide (metastable form), P 40 10 (rhombohedral)StructureRhombohedral, R3c (161), Z=2. The structure was determined by de Decker andMacGillavry [1941]. Using their data,Cruickshank[1964] refined the structure.d(A)Calculated Pattern (Peak heights)/hkl28(°)A = 7.54056 ALattice parametersa= 7.44A, a= 87°, [de Decker and MacGillavry, 1941]. The corresponding hexagonal parameters are a= 10.25, c= 13.55A,with Z= 6.Density(calculated) 2.30 g/cm3MacGillavry, 1941] •Thermal parametersIsotropic P(l) 2.13P(2) 1.950(3) 4.740(4) 1.810(5) 1.990(6) 2.70Atomic positionsCruickshank [1964][de Decker andPolymorphismI de Decker [1941] described a stable orithorhombic phase of P2 O 5 with a space: group Fdd2 (43). Hill, Faust, and Hend-\ ricks [1943] identified a third formwhich was thought to be tetragonal but? was later shown to be another orthorhom-; bic phase with space group Pnam (62)! [MacGillavry et al., 1949].I Scattering factorsI 0° , P° [3.3.1A]5.395.123.713.393.263.173.C12.9592.5632.4232. 38**2.3m2.2592.2292.1082.0672. mi*1.9921.9511.7801.6911.6771.6641.6281.5221.5121.4791.4221.3471.3271.3H21.2981.2461.2381.1761 0 076310201?21937149523123111p1113l111?11\1 1 0-110200210-2 1 02 1 121-1-211-220-2 2 13 1 0-3 1 02223 1 -13 ? 0 +t ? 1-32032-13 -2 132-24204 2 1332 +-420430431-422-431-432-5 2 1530531-4334 4 -2 +-53216.4417.3023.9626. 2827.362P.1629.6Q30.1834.9837.0837.7038.8339.0340.4442.8643.7644.9845,5046.5251. 2B54.0854. 6B^5.1456.4660.8261.246?. 7665.6269.7870.9472.5272.7876.3476.9381.36Scale factorj (integrated intensities) 3.590 x 104I Additional patterns| 1. PDF card 1-213 [Hanawalt et al., 1938]| 2. Hill, Faust, and Hendricks [1943]| 3. Thilo and Wieker [1954]91

Phosphorus Oxide (metastable form), P4 010 (rhombohedral) - continuedd(A)5.395.123.713.393.263.173.012.9592.5622.422Calculated Pattern (Integrated)/100764IT23142s?

Potassium Hydrogen D if or mate, KH(HCOO) 2StructureOrthorhombic, Pbca (61),Z=8 [Larsson andNahringbauer, 1968]Lattice parametersa=17..7086 ± 0.0009, b= 7.5096 ± 0.0004,c= 7.3774 ± 0.0004JI(published value:a=17.7079±.0009i) [ibid.]Density(calculated) 1.76 g/cm3 [ibid.]Thermal parametersIsotropic: K0(1)0(2)0(3)0(4)2.723.493.264.383.49C(l) 2.63C(2) 3.00Scattering factorsH°, C° [3.3.1A]O° [3.3.1A] corrected for dispersion byAf'=0.0 and Af"=0.1 [3.3.2B]K° [3.3.1A] corrected for dispersion byAf'=0.3 and -f"=l.l [3.3.2B]Scale factor(integrated intensities) 4.047 x 104ReferenceLarsson, G. and I. Nahringbauer(1968) .ActaCryst. B24, 666.d(A)8.6565.04644. 52554.42713. 92773.754?3.68973.61003.40363.?R843.28773.25473.12933.10162.95112.93792.91172.88782.86432.83422.74612.66972.65132.63162.60342.57442.55452.52252.43262.41872.40872.34932.31672.28952.?fl062.25972.21402.20362.17922.1731Calculated Pattern (Peak heights)/100651I121254144947414f>27125e^32B201132114451312?208S•*? o108hkl2001 1 12 1 14003 1 1020002102202

Potassium Hydrogen Diformate, KH(HCOO) 2 - continuedd(A)1.94271.90681.87621.A4341.83991.B3221.R1921.809*1.805B1.78791.7R201.77111.75531.74591.73851.73611.72871.71371.70251.68751.68291.67831.66601.64831.59391.56521.55041.51231.50831.50521.49991.49211.490*41.47591.47171.46921.46671.44671.44311.43991.42891 .42661.41131.3R651.38541.37501.35041.33991.33861.3265/3Q334731217111->11I2144111113p1132122?3321111112112hkl3236 3 04320 0 U +8126 1 30411 U 1? 0 45322 '4 110 0 02141 3 33 4 19024403 1 44046234 n 1 +10 3 11421 2 43 ? 410 ? 14248326339 1 352404370412 0 0 +24310 2 21 5 13 4 3 +1 1 53342 1 593210 1 31 5 272454312 2 15 1 5650634 +26(°)0X = 1.54056 A46.72U7.6Q4R.4849.404^.5049.7250.1050. 3B50.5051.0451.2251.5652.0652.3652.6052.6852.9253.4253.8054.3254.4854.6455.0855.7257.8058.965^.5861.2461.4261 .5661.8062.1662.2462.9263.1263.2463.3664.3464.5264.6865.2465.3666.1667.5067.5668.1469.5670.1870.2671.00d(A)8.8545. 04474.52394.42723.92823.754B3.6B873.61123.40503.3R7P3.2B813.25453.13023.10112.95142.93832.91112. 88762.86362.83392.74692.66952.65142.63142.60282.57422.55482.52232.43242.41862.40882.34952.32042.31692.28982.28012.26202.25962.21362.20312.17902.17292.11222.08982.08632.06672.05732.05722.04042.0180Calculated Pattern (Integrated)/83551113126424110044549271359q331211?333155?13143322Q9122212332110210221hkl2001 1 12 1 14003 1 10200021 0 22024111 2 11 1 22212 1 26005 1 13 2 13 1 24204026 1 04214120221 2 26 1 15022225 2 15 1 22301 3 16201 1 32317 1 14222 1 38006 1 24303 1 35224317024 1 3132023B 1 172120(°)A = 1.54056 A9.9817.5719.6120.0422.6223.6824.1124.6326.1526.2827.1027.3828.4928.7630.2630.4030. 6 Q30.9431.2131.5432.5733.5433,7834.0434.4?34.8235. in35.5636.9237.1437.303R.2838. 7R38.8439.3139.4Q39.8239.8640.7340.9341.4041.5242,7843.2643.3343.7643.9843.9844.3644.8894

Potassium Hydrogen Diformate, KH(HCOO) 2 - continuedd (A)/hkl200 c\ = 7.54056 Ad (A)Ihkl26C)X = 1.54056 A2.0168?.003F1.95451 .9506l.°4261Ii1 '4? 3 22 2 33325 1 33 ? 344. °145.2146.4?46.5?46.7?1.44001.428R1.42661.41141.3868p11113342 1 593210 1 31 5 264.6^65.2465.3666. IS67. 4n1.90911.87611.^4431.8430l.r-4021?^21'46304320049 1 13 1 247. 5Q48.4F16 1 30411 4 120453249.7?50.0950.3^50.^0R1.041.3P711.32641.2R711.28041.2711^v45263412 2 2525113270.9671.0073.5273.9774.60p1111 11111 p1I1.7*221.77091.75561.74571 .738731P1P2 u 110QO2 1 41 3 33 4 1SI .??51.5752.0552.37B2.591.26781.25831.23401,20371.19651 3 5652061306140274.8375.4977. ?S79.57BO. IS1.73611.7281*1.71401.70251.6R77111^i9024403 1 44 0 46 ? 3S?,.6«52.93S3. 4153. BO54.311 .18901 .177R1.15231.1461P 4 385212 0 412 4 1R0.7681.69R3.90R4.461 .6*281.6*161.67841.66571.6i*8?3pt opp44133310 \ 11 4 21 ? 454.4854.5354.6455. 0^55.7?1.63581 .60971.59391.56521.5506111?15043423 ? 410 2 142456.1957. IP57.8058.9659.571.51241.50801.50521.49971.4922c.I1 14^326339 1 35240 u 361.2361.4361.5661.8162.151.49031.47711.47571.47151.46922111P70474112 0 0243102262.2462. R662.9^63.1363.241.46671.44801.44671.44571.443011312112511034310 3 01 1 563.3664.2864.3464.3964.53 195

Potassium Oxalate Perhydrate, K 2C 20 4 *H 20 2StructureMonoclinic, C2/c (15),Z=4, The structurewas determined by Pedersen [1967].Lattice parametersa=8.969, b=6.532, c=10.955Jl, 8=108.4°[ibid.]Density(calculated) 2.184 g/cm3Thermal parametersIsotropic: K 3.0301 3.15Op 3.8002 2.89C 2.91Scattering factorsK°, C°, O" 1 [3.3.1A]Scale factor(integrated intensities) 1.490 x 104ReferencePedersen, B.F. (1967). Acta Chem. Scand.21, 779.d(A)5.1935.0414.3164.2554.0813.9623.3613.2663.1753.1162.8772.7662.7152.6542.63b2.6152.5992.5252.5202.40752.376B2.36962.2^742.1*122.1592Calculated Pattern (Peak heights)£0O 0/fefelA = 1.54056 Ain5311621145234577?920533197254100u191?3

Potassium Oxalate Perhydrate, K 2 C 20 4 -H 20 2 - continuedd(A)1.61901.61331.58781.58581.57841.57451.55521.53361.50961.50611.49341.48911.48441.45771.45241.44871.43911.43441.41051.38431.36031.35381.34031.33761.33461.32651.32161.31681.30761.29011.2P231.2740! 1.27051.25621.22931.22661.22431.21691.21461.20491.19691.19341.19141.09361.C7411 .06141.06031.04981.0122/3?4424123553113?1224212?2I3??312oI1?111I111111111hkl3 1 4041-226-3 3 41 3 4-4255 1 1-241-P 4 2-1 1 7-602225241-243206-426 +3333 I 5-227-532 +117 +-623-621 +5 1 3-534-a 2 7-118 +424-4 0 81 3 6-6251 5 16024 4 1-153532-626-536-246425-3 5 12 ? 7-3 1 9060I 5 5730-823-5 5 3551 +26(°)A = 1.54056 A56.8257.0458.0458.1258.4258.5859.3860.3061.3661.5262.1062.3062.5263.8064.0664.2464.7264.9666.2067.6268.9869.3670.1670.3270.5071.0071.3071.6072.1873.3273.8474.4074.6475.6477.6077.8077.9878.5478.7279.4880. 1280.4080.5690.0691.6493.0693.1394.4099.10d (A)5.1975.0404.3184.2554.0833.P623.3613.2663.1763.1162.8772.7652.7162.6552.6542.6362.6152.6022.5992.5912.5262.5202.40772.37662.367R2.29752.18152.16242. 159C2.12762.10942.09642.07202.03642.03352.01011.98101.91731.90661.90331 .86791.84051.84001.81741.81281.79901.78941.78271.75941.7538Calculated Pattern (Integrated)/1155117241662427189112646273655955349100525p4l nI2?in17o1>>5?331l17233pp1513q5'4hkl002-1111 1 1200-1 1 2-2021 1 2020-1 1 3021202022-3 1 1-3 1 21 1 3-2 2 1-2043 1 0004220-1 1 4-2222 P 10233 1 1-223-3 1 41 1 42224001303 1 2-1 1 51 3 1024-132-4Q4-3 1 52231 3 2-133313-421-2061 1 5-225-423420-3 3 102526( c)X = 7 .54056 A17.0517. 5P20.5520.8621.7522.42?6.5027. 2P28.0723.6331.0632.3532.9533.7433.7433.9034.2634.4434.4834. 5935.5235.5^37.3237. B?37.9739. 1M41.3541 .7441.8142.4542.8443.1143.6544.4^44.5245. OF,45.7647.3747.6647.7448.7149. 4^49. 5n50.1550.2950. 7n51.00SI. 2051. Q 352.1197

Potassium Oxalate Perhydrate, - continuedd (A)/hkl26(°)X = 1.54056 Ad(A)/hkl20O\ - 1.54056 A1.747?1.74241.74221.70951.70143UP1o'4-1 1 6-3321 3 3-5 1 1-134^P.3P52.4752. 4P53.5653.741.25621.24201.22941.22681.2244p13P1441-7 1 4-153532-62675. 6476.6677.5977.7977.971 .70291 .6R4141 .68041.68011.619?25115-5 1 34 P 12 ? 4-3 3 33 3 453.7Q54.4354.^754. 5R56.81i.?i?n1.21471.2051)1.1^691.193211121-536-2464?5-3 5 122778.5378.7179.4780.1?80.411.613?1.5PR11.585P1-57851.5747p54?.R0 t| 1-2 2 6-3341 3 4-4 ? 557.0458.0^58.1?58.4?58.571.19131.16771.14771.12951.11631111I-3 1 9-7 1 67 1 1-247633BO. 578?. 5584.3185. 9 Q87.271.55501.533b1.50981.50631.4933o3i*5R5 1 1-2 4 1-242-1 1 7-60259.3^60. 3C61.3^61 .5162.101.11291.0 Q 471.08871.08401.0795111i1-^29-3550601 1 9444R7.60R9.4490.07^0.57PI. 051.48791.48451.477?1.45761.45241.44861.44791.43931.43431.41061.38511.3B441.36091.36001.3538151141113317P912252 4 1043-P 4 3206-4265 1 23333 l 5-? 2 7-244-532-3361 1 7-6 2 362.3662.5162.8663. 8H64.0664. 2S64. ?P64.7164.9766.1967,5767.6]68.9469.0069.361.07m1.06151.06041.055B1.049^1.015,31.01221.01151.0000.97751111?111111 5 57 3 0-* 2 3-8 P 4-5534^55518 2 0-7 1 9-3 3 1091.6493.0593. 1803.70Q4.4093.6^»99.1099. ?n100.76104.001.34101.34071.33961.33761.334611o1p530243-6 ? 15 1 3-53470.1?70.1370.2070.3?70.501.32651.32191.32171.32071.31661.30761 .29021.28241.27401.27031131336p42"427-5 1 7-1 1 B-606424-408136-6251 5 160271.0071.2971.2971.3671.6172.1873.3173.8374.4074.6698

Potassium Sulfate, K 2 S 20 7StructureMonoclinic, C2/c (15), 2=4 [Lynton andTruter, 1960]Lattice parametersa-12.35±.005, b=7.3l±.005, c=7 .P = 93°7 / ±4.5 / [ibid.]Density(calculated) 2.58 g/cm3 [ibid.]Thermal parametersIsotropic: K 1.77S 1.120(1) 1.970(2) 2.000(3) 2.020(4) 1.34PolymorphismHahle[1968] described a high-temperaturepolymorph called the o--form, and confirmed a transition temperature of 330°C.Scattering factorsK"1", 0° [Berghuis et al., 1955]S° [Tomiie and Stam, 1958]Scale factor[integrated intensities] 2.999 x 10 4Additional patterns1. PDF card 1-717 [Hanawalt et al.,1938]2. PDF 21-683 [Bazarova et al., 1968]3. Hahle and Meisel, [1968]ReferenceBazarova, Zh.G., G.K.Boreskov, L.M.Kefeli,L.G. Karakchiev, and A.A. Ostan'kovich.(1968). Proc.Acad.Sci. USSR, Phys. Chem.Sect. (English Transl.) 180, 421.Berghuis, J., IJ. M. Haanapel, M. Potters,B.O. Loopstra, C.H. MacGillavry, and A.L. Veenendaal (1955). Acta Cryst. 8,478.Hahle,S. and A.Meisel (1968). z. Chem.8,241.Hanawalt, J.D., H.W. Rinn, and L.K. Frevel(1938). Ind. Eng. Chem. Anal. Ed.10,457.Lynton, H. and M.K. Truter(1960). J. Chem.Soc. 1960, 5112.Tomiie,Y. and C.H. Stam (1958). Acta Cryst.11, 126.d(A)6.286.164.824.6873.6543.6303 . 5 8 13.?643,2043.1533 , 1 4 43.0833.0562.9152. 8552.6122.5762.4912.4152.3902.3562.3452.2772.2702.2372.2J52.1912.0962.0552,0512. 0182. 0061.9991.9871.9431.9401.P.921.8371.B321.8141.7°!1.7721.7671.7581.7481.7341.7261.7201.7091.697Calculated Pattern (Peak heights)/10545254710510077151475gp442315175514194206P1^1?3352103282411432•212?646Rp1hkl1 1 0200-1 1 11 1 1020o n 23 1 00 ^ 1 "202+3 1 12204 n o202-2 P 12 2 1-3 1 20223 1 2-4 0 21 3 04 ? 0? 2 2-113 +"4211 1 34 P 15 1 1330600-3 l 3023-1323 3 11 3 2-223422223-3 3 2-6 o 2004620041-2 n 4-621 +602530 +-513 +621-P u 12 4 12*D cA = 1.54056 A14.0914.361H.40IP. 9224.3424.5024.8'427.3027.8228.2828.3628.9=429.2030.6431.3034.3034.8036.0237,2037,6038.1638.3639.5439.6640.2840.7041 .1643.1244.0244.1244,8845.1645.3245.6246.7046.8048.0449.5849.7250.2450.9451.5251.6351.9652.2652.7653.0253.2053. 5B53.9899

Potassium Sulfate, K 2 S 20 7 - continuedd (A)1 .6871.6721.6541.6321.602l.bRB1.5771.5731 .5691.5631.5531.5451.5411.5281.4731.4701.45B1.4481.4381.4301.4281.4251.4091.3681.3641.3581.3511.3491.3451.3351.3121.301!.?

Potassium Sulfate, K 2 S 20 7 - continuedd(A)7hkl2enA = 1.54056 Ad(A)/hkl20(°)A - 1.54056 A1.7331.7311.7261.7241.720515575301 1 4-513-4236 2 152.7752.8553.0153.0653.201.2961.2R81.2781.2701.26321111-352044-534-24464272.9573.4874.1?74.6575.141.7131.7091.6971.6871.6721.6541.6321.6071.6031.5R8 ~1.5881.5771.5721.5681.56312123511833it-111710-241241-7 1 1531423042-333-404-532-24262244024233353.4653.5753, 9R54.3454.8855.5056.3257.3057.i*658.0458.0558.4758.6858. R?59.051.2631.2601.2581.2411.2331.2301.2181.2141.2141.2041.2001.1941.1881.1751.1723312 ->12143?_14I11-5 1 5-4255509 1 25515340607 1 4425-9 1 3-2069303532064 H 475.1875.3975.5476.7277.2977.5378.4378.7778.7879.5179.9080.32RO.R581.9182.161.5531.5451.5411.5281.5281.M741.4711.4581.4471.438135233??21224-4 4 15324044 t| 1-623-514043-P 0 21 3 459.4659. ROS9.9660.5460.5663.0363.1*63.7764.3164.771.1711.1511.1491.1401.1391.1381.1371.1371.1331.13211]1?51433643-9320 ? 6-226-262-7 1 5-1540 U 546026282.23R4.03P4.2385.03R5.1?R5.2485.2785.3185.66R5.7°1.4301.4281.4251.4091.40855?_o?-243730-15124362365.2065.3165.4?66. 2P66.3?1.1301.1291.1191.1181.10021131154-553932-7 5 111 1 085.9386.0687.0?87.1388.071.4071.3681.3641.3581.354•>1711-821-3 1 57 1 3-3

Rubidium Oxalate Perhydrate, Rb 2 C 20 4 -H 20 2StructureMonoclinic, C2/c (15),Z=4. The structurewas determined by Pedersen [1967].Lattice parametersa=9.251, b=6.808, 0=11[ibid.]Density(calculated) 2.892 g/cm3Thermal parametersIsotropic: Rb 3.950 1 4.61Op 5.0402 3.72C 4.30Scattering factorsC°, Rb0 , O- 1 [3.3.1A], 13=107.45'Scale factor(integrated intensities) 4.195 x 10 4ReferencePedersen, B.F. (1967). Acta Chem. Scand.21, 779.d(A)5.3885,2111.1911.1111.1991.0513.1883.1013.2573.2132.9902.8702.8082. 7183. 7352.7012.6712.6062. 5892.b062.16102.36812.29622.21682.23082.2D672.19712.18022.12132.mos2.08782.0P1B1.98121.95851.Q3611.91331.90731.87251.85531.85111.61691.81311.82711.80981.B0581.79711.79191.78161.76921.7628Calculated Pattern (Peak heights)/192?7716336621?85ion8335217553^50563?Q21Q117811191557203613165751083 ;>775i*127hkl1 1 0-i i ii i i? n o-l l 2-2021 0 1 2 20-1 1 30 2 1202022-3 1 11 1 3-? ? 1 +310 +001 +-2 ? 2-111? 2 10 ? 3 +-223-1022 ? 2-3 1 11001 3 03 1 2-115 +021-132-101132 +-3 1 b-1333 1 3-121I 1 5-206120 +-225-123-331025-332330-1 1 6-5 1 2-5 1 1-1312$n oA = 1.54056 A16.1117.0019.7120.1021.1121.9225.5226.1627.3627.1829.8631.1131.8132.5632.7233.1133.5231.3831.6235.8036.1837.9639.2010.1010.1010.8611.0111.3812.5213.0213.3011.7215.7616.3216.8617.1817.6118.5819.0619.1819.3019.1019.8650.3850.5050.7650.9251.1151,6251.82102

Rubidium Oxalate Perhydrate, Rb2 C 20 4 -H 20 2 - continuedCalculated Pattern (Integrated)1.75151 .740*41.71971.6*121.635Q5.2124.4Q34.4134.19816.4317.0019.7420.1121.144.0503.4883.4043.2533.2431.50211.49511.46821.47931.44671.43361.40261.39931.39561.39161.38791.37861.37571.36861.3F551.34971.34601.34461.33561.33231.32781.32031.316P1.30761.27811.27641.25451.25201.25031.24751.24561.24311.23471.2172•>32o43319*>23•-1 1 8-517 +-2 4 5 +-^43136 +-^08 +1 5 16 0 2-64pit5i-153 +532 +-626 +

Rubidium Oxalate Perhydrate, Rb 2 C 20 4 -H 20 2 - continuedd(A)/hkl20Oc\ = 1.54056 Ad (A)/hkl26(°)X = 7.54056 A1.82751.80971.80601.796B1.7Q13295•S3-331025-332330-1 1 649.8650.3850.4950.7750.941.36691.35721.35551.35011.349432223424-427-1 1 8-606-5 1 768.4969.1669.2669.5869.621.78461.76911.76291.75161.75141210107-5 1 2-5 1 1-134421-5 1 351.1451.6251.8?52-1852.181.34761.34601.34451.33561.335511p43-4251 1 6-241-242? 4 i^6.9P57.3457.7?58.8059.741.25501.25431.25201.25021.2476I1p11-626-2464 ? 5-5 3 6-44575.7375. 7R75.9476.0676.251.54451.54251.54131.53561.5123717p3-1 1 7225-602043-2 H 359.8^59.9?59.9760.2161 .241.24551.24311-23471.21711.1952p{?11-3 5 1-7 1 5227-3 1 93 1 776.4176.5877. 2H78.5280.?^1.50551.50231.49511.48811 .47922^o^i5 1 22064043 1 52 4 261.5561. 6 n62.0?62.3562.771.19181.18111.16501.16101.1378i11P17 1 1-138-? 4 7623-42980.5381.4182.7883.1385.211.47091.44651.43701.43531.433514117600-227-1 3 b044-53263.1664.3564.8364.9165.001.13471.13331.12841.12431. 1?0911.1110 ft 0-3 5 5-7343530 ? 985.51R5.6386.1086.4986-8?1.40411.4H271 .3^941.39631.3954123i^-6 ? 21 1 7-336-^ 2 3? 4 366.5466.6?66.7966. 9e67.011.11711.11591.10331.10211.0 Q 49121p11 1 9155-5 3 3730-823R7.1PR7.3088.5588. 6RR9.4P1.303?1.39101.38791.37851.3760ip43p5305 1 3-62133^-53467.1767.?^67.4?67.9468.061.09391.08361.06081.05591.05351o111-645-5532624455 ^ 189.5?.90.0^Q3.1?93.6903.96104

Sodium, NaStructureCubic, Im3m (229),Z=2. The structure wasdetermined by Hull [1917].Lattice parametersa = 4.2908 A ± .0005. (published value,a = 4.2906 A ±,0005) [Aruja and Perlitz,1939].Density(calculated) 0.966 g/cm3Thermal parametersIsotropic, overall B=2.0d(A)3.03352.14551.75151.51721.35681.23871.14671.0113.9595.8415Calculated Pattern (Peak heights)/10015235614211hkl1 1 02002 1 12203 1 0 +? 2 2321 +411 +420 +431 +26( c)A = 1.54056 A29.4242.0852.1861.0269.1876.9084.4099.22106.80132.52PolymorphismSodium.has a face-centered cubic structure at -195 °C [Barrett, 1948]..783415 ? 1 +159.00Scattering factorsNa° [3.3.1A]Scale factor(integrated intensities) 0.09447 x 104Additional patterns1. PDF card 1-850 [Hanawalt et al.,1938]2. Hull [1917]ReferenceAruja, E.and H. Perlitz (1939). Z. Krist.100, 195.Barrett, C.S. (1948), Am. Mineralogist 33,749.Hanawalt, J.D., H.W. Rinn, and L.K. Frevel(1938). Ind. Eng. Chem. Anal.Ed.10, 457.Hull, A. W. (1917). Phys. Rev. 10, 661.d(A)3.03412.14541.75171.51701.35691.35691.23861.14601.14681.01131.0113.9594.9594.9148.8759.B41b.8415.7834.7834Calculated Pattern (Integrated)I1001^2934421441oii1ii i2?hkl1 I 02002 1 12203 1 00132223 2 11233304 1 14 2 00243324 2 24311 3 41 2 55 2 12B(°)X = 1.54056 A29.4142.0852.1761.0369. IP69, 1R76.9184.4084.4099. 2?99.22106.801 06.80114.71IP3.15132.52132.5?159.01159.01105

Sodium Calcium Carbonate Hydrate, pirssonite, Na 2 Ca(C0 3 ) 2 *2H 2 0StructureOrthorhombic, Fdd2 (43), Z=8. The structure was determined by Corazza and Sabelli[1967].d(A)Calculated Pattern (Peak heights)/hkl200 oA = 1.54056 ALattice parametersa=11.32±0.02, b=20.06±0.02, c=6.00±0.02i[Evans, 1948]Density(calculated) 2.360 g/cm3Thermal parametersIsotropic [Corazza and Sabelli,1967]Scattering factorsH°,Na°,Ca°,C°,0° [Cromer and Waber,1965]5.1?.5.014.934.153.753.203.162.8P2.882.832.722.652.562.522.51100iin7414340564^4175391933377l l 10 (4 02201 3 12401513 1 13 3 1 +0224004202022221710 B 017.3017.6817.9821.3823.6327.8628.2631.0031.0831.5832.8633.7834.9835.5835.78Scale factor(integrated intensities) 6.393 x 104Additional patterns1. PDF card 2-1051 [Dow Chemical Co.,Midland, Michigan]2. PDF card 22-476 [Fahey and Mrose,1962]2.502.342.292.232.162.132.112. OR2.052.0281o2*4125^363IS643512422 R 00624603 7 15 1 12621 9 14 2 2 +35.9036.3839.2640.3641.7842.3442.9043.5444.0444.92ReferenceCorazza,E. and C. Sabelli(1967).Acta Cryst,23, 763.€romer, D 0 T. and J.T. Waber (1965). ActaCryst. 18, 104.Evans, H.T.,Jr. (1948). Am. Mineralogist33, 261.Fahey, J.Jo and M.E. Mrose (1962). U.S.Geol. Surv. Profess. Paper 405, 1.1.9601.8901.9771.8731.8541.8271.3211.7681.7631.75312110g12530432881 1 32 10 04-4805516203912 B 2153 +3 1 346246.2848.1048.4648.5849.1049.8650.0451.6651.8252.141.7251.7081.7041.6681.64341317941 11 13335710 10 266053.0653.6053.7655.0255.921.6361.6231.6031.5991.597453744 10 01 7 32 12 02 10 260256.1656.6657.4457.5857.681.5911.5841.5771.5571.535213654823 11 16227 1 159157.9058.2058.4659.3260.22106

Sodium Calcium Carbonate Hydrate, pirssonite, Na 7Ca(CO,) 9 '2H 70 - continuedd(A)/fcfeZ26(°)X s 1.54056 Ad (A)/hkl26(°)A - 1.54056 A1.5221.5071.5041.5001.463132656642 +6 P, 037300453360.8261.4661.6261.7863.561.100,01.0^31.093l.ORO1 .078?1p1335579321^ 08 12 0o 9 iB9.9289.39P9.5891.0091 .261.455I.f4411.4371.^-151.393p5113P7 5 16624 10 2 +P 0 0 +24463.9264.6264.8465.9667.141.0751.0631.0621.0591.047?\1125 13 39 1 3375100253591.5492.8492.9893.3294.721.3891.3861.3821.371*1.3711.3621.3301.3141.2971.287742p9324613 13 13935 11 16 10 07 7 18402644241 15 1 +0 B 467.3467.5467.7468. IB68.3668,9070.7671.7872.8873.501.0581.0361.0311.0291 .0281.0201.0191.0131.0101.00844p11I1225a 12 410 d 2 +5 17 19532 1A 29 11 12 14 411 1 1 +10 6 284495.7696.0696.7096.9297.0498.0498.1899.0099.4499.621.2*11.2791.269l.?601.2554n1P34447 Q 1 +3 11 32 14 27 1 373.9074.0874.747S.3475.721.003.998.995,9P5.9R3211113 19 1 +5 15 302620611 5 1100.40101.04101.44102. P2103.121.2541.2471.244t .2361.2^4?1P13n 16 05 13 15937333 15 175. PO76.2876.5277.1277.23.980.976.975.962.^60311214 18 2 +10 8 27 13 30 16 4 +6 18 0103.62104.23104.40106.38106.781.2321.2291.2151.2001.1^53

Sodium Calcium Carbonate Hydrate, pirssonite, Na 2 Ca(C0 3 ) 2 > 2H 20 - continuedd(A)5.135.014.934.153.753.203.152. 882.882.872.832.7?2.652.562.522.512.502.342.292.232.362.132.112.082.052.022.0?1 .9601.8911.^891.R771.8731.8541.P2B1 .b?21.7681.7661.7601.7531.7241.7081.7031.6681.6431.6371.6231.6031.6001.5971.591Calculated Pattern (Integrated)/903464133416147312p,551 0 19'-}31746nq3>4146140317IT6^->16l r>1141443^6")14o51615115573722hkl1 1 10402 ? 01 3 12401 5 13 1 13 3 12600224 p 04 ? 0202P 2 21 7 1n B o351? 4 22 R 00624603 7 15 1 1? 6 21 9 15 3 14221 1 32 10 01 3 34 R 05516?0391? R 21 S 36403 1 34621 11 13335710 10 26 6 04 10 01 7 32 12 02 10 26024 P 22 BOA = 1.54056 A37.2^17.6717.9??1.37?3.6*?7.8628.2731.0031.0431.0931.593?. 8633.7934.9^35.5835.7835.91"S8.3R39.2740.3641. 7R42.3442. 9P43.5444.0444. 8^44. 9346. 2*48. OR48. 1?48.4648.5649.0^49.8550.0351.6651.7?51.9052.1353.0653.6053.7755.0?55.9156.1656.6657.43S7.57^7.67S7.Q1d(A)1.5641.5771.5571.5351.5321.5211.5081.50*41.5001.4631.4551.4411.4371.4371.4351.4151.4141.3931.3891.3351.3821.3741.3711.3621.3381.3301.3J41.2981.2971.2871.2R11.2791.2781.2691.2601.2551.2541.2471.2441.2361.2341.2321.2291.2151.2001.1951.1 861.1761.1751.172/14962411749273114413913**15155Ia251^1i34?2p04 r>5*}443?_?pfcfe/3 11 16227115916427316 8 03730045337516620 4 44 10 2224BOO2 12 22443 13 13935 11 16 10 07718 4 01 11 32644244 12 21 15 10 P 44 4 47914 14 03 1] 3P 14 27 1 30 16 05 13 15937333 15 14649 1 11 13 3753* 6 27 11 14 14 22 10 44 R 420C)A = 1.54056 A58.2158.4759.3160.2260.8260.8761.4561.6161.8063.5663.9264.6264.8264.8464.9365.9666.0267.1567.3467. 6C67.7568.1868.3668. 8P70.2970.7771.7872.8?72.8973.5173.9074.0774.1174.7475.3475.7?75.8176. 2R76.5377.1177.2877.3°77.6478.7179.8780.2581.00R1.6481.9182.20108

Sodium Calcium Carbonate Hydrate, pirssonite, Na 7Ca(CO,) 7 -2H 9 0 - continued3'2d(A)/hkl20(°)A = 1.54056 Ad(A)/hkl2e(°)A = 7.54056 A1.1661.1621.1581.1551.152p43^26243 13 35 11 36 12 277382. 6P83.01R3.4083. 6PP3.97.980.976.975.969.9662111122610 R 27 13 33 11 5246103.62104.28104.41105.3?105.721.1461.1441.1431.1421.141142114 16 01 5 56443 1 56 14 084.44R4.6784.72R4.86P4.92.963.962.962.960.95811p117 1 59 13 10 16 46 18 0066106.31106.35106.40'106.79107.031.1331.1271.1161.1081.107361332 16 23350 12 46643 17 1P5.6386.21P7.2588.1188.20.957.956.954.952.9451231159511 7 18 m 2P R 45 19 1107.1?107.34107.61107.00109.211.1061.1061.1001.0951.09351ppP1 15 34 10 43557932 18 0A8.2 C>88.3188.9?89.3989.57.944.941.940.939.9383p1111 13 57 17 11 21 14262 20 2109.37109.81110.041 10.2^110.301.0801.0791.0781.0751.063p1511B 12 08 10 29915 13 39 1 390.9091.1191.2691. 5292.85.937.927.923.919.91 91111110 10 25 17 311919 11 33 13 51 10.661 12.36113.10113.80113.941.0621.0591 .0531.0471.0391?1^737510 0 210 ? 25354 12 4P2.9R93.3?94.0004.7195.75.917.917.016.908.907p31325 11 52867 15 36 14 44661 14.361 14.36114.451 16.03116.171 .0361.0351.0311 .0291.0274p41110 4 27 11 35 17 1953? IB 206.0396.1fS06. 7P96.^207.14.906.900.896.895.8951123p0 15 110 2 412 ? 20 10 610 1? 2116.5?117.7311 8. SO118.791 1 8 . P 51.0241.0201.0191.0131.012121218249 11 12 14 411 1 11 17 307.5898.0408.1909. on09. in.890.8P9.«R6.886.R84111111 15 5104411 11 16 20 0? 18 41 19.70120.04120.681?O.P6121.331.0101.0081.0031.0031.002p10I1p10628 U 40 20 011 313 19 109.4409.6?1.00.34100.37100.4?.883.876.B75.874.8723pp1312 K 08 1? 7 19 415 13 510 6 41?1.4^1P3.011^3.461?3.6U124.03.998.995.985.983.980112145 15 302620611 5 14 18 2101.051 01 .45102.93103.13103.6?.^70.869.869.867.863431116463 15 512 6 29 1 55 lo 31 24.561P4.81124.86125.25126. 3S109

Sodium Molybdenum Oxide, Na 2Mo 20 7StructureOrthorhombic, Cmca (64), Z=8. The structure was determined by Seleborg [1967] 0d (A)7hkl20D oA = 1.54056 ALattice parameterse=7. 164±0.006, b=ll.837±0.004 , c=14.7l4±0.002A.(published value: c=14.7l3±.002A)2.5992.5662.5342.5-182.452111°131132 ? 32040431 3 400634.4834. P435.4035.6236.62Density(calculated) 3.725 g/cmsThermal parametersIsotropic [ibid.]Scattering factorsNa + , Mo3+ , O' 1 [3.3.1A]. The values forNa + and Mo3+ were corrected for the realpart of the dispersion correction, using£f=0.1 and Af=-0.5 for the sodium andmolybdenum respectively.2.3542.3052.2652.2542.2312.2222.1492. 1222.1132.0872.0692.0432.0241.9R81 .9801213643166?.5102 *^c,.2q2240440262 4 13 1 21 5 11 5 22253 1 30 r* 5243153331 +1 1 702738.2039.0439.7639.9640.4040.5642.0042.5642.7643.3243.7244.3044.7445.6045.78Scale factor(integrated intensities) 32.52 x 104ReferenceSeleborg, M. (1967). Acta Chem. Scand.21,499.d(A)7.365.925.655.434.706a. 6093.8283.7763.6783.3633.2203.1533.1253.0643.0002.9592.9012.8292.7462.635Calculated Pattern (Peak heights)/301?'41009144354626866a?9236Q1511014hkl0020201 1 10211 1 20221 1 30 2 30041 3 12021 1 4024 +220? 2 104004122204202526(°)A = 1.54056 A12.0214.9615.6616.141 Q-.R419.2423.2223.5424. IB26. 4B27.6828. 2B28.5429.1229.7630.1630.8031.6032.5834.00no1.9751.9691.9391.9151.9061.P861.8391.8031.7961.7^11.7871.7621.7571.7341.7141.7031.6821.6701.6391.6361.6321.6241.6181.6101.6061.5761.5641.5541.5461.5371.5291.5241.502241511341p13A181556?35162Q574672717Q613343314 +3322442260623330082451 3 74003341 1 80262270 14 7 +421262246 +3522082631 3 B423404172029264 +4242470663544 u 117445,9246.0646.8247.4447.6848.2249.5250.5850.7450.9451.0851.8652.0252.7653.4253.8054.5054.9256.0856,1856,3456.6456.8457.1657.3258.5259.0059.4459.7860.1460.5060.7261,70

Sodium Molybdenum Oxide, Na 2 Mo 20 7 - continuedd(A)1.5001.4811.4721.4631.4501.4U61.443/4 '*33377hkl442'* ? 5 +n 9 14430 8 23184P ? 926(°) oA = 7.54056 A61. *0ft?. 6863.1063.5664.1664. 3b64.54d (A)7.365.9?5.ftft5.404.709Calculated Pattern (Integrated)72ft1139590fcteZ0020201 1 10211 1 2X2 0(*)= 7.54056 A12.0?14.9615.6*.36.1318. P31.4311.4271.4231.4141.4053P3411 1 10 *-n 2 101 5 34444 P 665.1465.3265.5266.0066.50i*. 6113.e?93.77b3.6783.36543355620 ? 21 1 302300413119.23?3.21?3.5'4?**. 17?6.471.3971.3731.3671.3611.3581.3561.3541.3281.3261.326p1553•2vj?.4oft5 1 2n R 43384? 0 10 44 14 53721 3 104 ? 7 4460453266.946P.?668.6068.9269.1?6Q.?069.3670.8371.0271.043.2?13.1543.12B3.12**3.0ft**3.0002.P59P. 9012.8292.7^573714S57ion39in1711?? C, 21 1 4132n ? 42 2 02 2 1n u on i* i2 ? 2^ 4 2?7.6??8.?728.51P8.55?9.1??9.7 r-30.1830. 7P31.6032.5°1.3171.3051.2921.2831.271*1.2651.2591.2541.2461.2411.2381.2311.226l.??01.2191.2091.19441.17861.177?1.17041.16641.15391.15071.13341.13561.13281.12711.12403?.p1213o1?p1411P611271154?.2p? fl 3 *•46243744031 9 2534? 6 84 ? 83 1 1035844 14 71 5 100 0 1? 41940 U 115524286 +6024486 ? 046642 4110 10 32 2 12 46040 4124 A 2 42 10 071 .567?. 3673.1873.7374.4075.0475.4275.8076.3876.7476.9677.4677.8473.2878.3879.1480.3281.6281.7482.3282.6683.7684.0485.1685.4285.6886.2266.522.6352.5995.566P. 5342.5192.4522.3542.3062.?ft62.2542.2312.2222.1502*1232.1132. 0872.0692.0432.0242.0241.9«B1.9611.9751.9731.9681.9391.9181.9151.9061.68615122?1512412b47432nq151?.P112102475o41531025? ? 3204^431340062240440 ? 62413 1 21 S 11 5 22 2 53 1 30 (4 5? 4 31 5 33312061 1 70 ? 73 1 40603322441 5 422606233333.9^34. 4P34.9335. 4r35.6136.6138.1939.03•^9.7^39.9ft40.4040.5741.9942.5642.7743.3343.7?44. 2 Q44.7544.7545.5945.7745.9145.9646.0746.8?47.3647.4447. 6^48.21111

Sodium Molybdenum Oxide, Na 2Mo 20 7 - continuedd (A)/hkl20OA = 1.54056 Ad(A)IfcfeJ20(°)A = 1.54056 A1.P391.P031.7961.7911.7861.7621.7561.7331.7161.7141.7141.7031.6821.6701.6701.6391.6361.6301.6241.6181.6101.6061.5761.5641.5621.5541 .5461.5371 .5291.5241.5021 .5001.4811 .4801.4721 .4631.4511 .4461 .4461.44?1.4311.4311 .4281.4231.4171.4141.4051.3971.3731.368?17123 '•}-•)53113o?^3 C *4Sft1f\*?n1LJPirR1936^65o44t|'i;>60•71^1513130082451 3 74003341 1 B028? P 72614200474212622464223 S 22082631 3 84234041720?92640 14 B4242470663544 4 11744424250 B 0n a i443OQ24063 1 8? 2 90491 1 1002101580«34444265 1 20842 ? 049. 5?50. 5P50.8050.9551.1051.8652.0?52.7753.3353.4053.4253.7054.5054.9?54. 9R56.07^6.1756.4156.6456.8557.1657.3?58.5?59.0159.0^59.4459.7760.1560.5060.7261.6961.8-n62.6762.7463. IH63.5664.1564.3664.3664.5565.1365.1565.2965.5265.P.R65.9966.4966.9568.2768.561.3671.3621.3611.3591.3561.3541.3291.3281.3271.3261.3251.3181.3171.3051.3051.2921.2*31.2741.2651.2591.2541.2461.2411.2401.2381.2311.2261.2261.2201.2191.2101.2091.19441.19401.18311 .17861.17721.17041.16871.16671.16641.15391.15071.14631.13941.13841.13821.13731.13571.172B73423?.143441321313153131?p4P2113in1lp3310a? iiii72p313382 e i2 0 104453721 3 102494275144605320 4102834620 2 113744081 9 25342684283 1 103582854471 5 100 0 122 2 111 9 40 4110 8 75522 P 63 3 104296024486 P 00 10 26214662 4 110 10 32 8 76232 2 123924 B 16040 4 1263.6068.9068.9469.0569.2169.3670.8570.8ft70.9971.0271.1171.5671.5772.3572.3773.1973.7874.4075.0575.4175.8076.3976.7476.7976.9477.4677.8477.8^78. 2R78. 3P79.0879.15^0.3280.3581.2481.6281.73A2.31S2.4682.63«2.6583.75R4.04R4.4485.1685.1685.1385.2705.42R5.69112

Trimethylammonium Chloride, (CH,),NHCIStructureMonoclinic, P2 X /m (11),Z=2 [Lindgren andOlovsson, 1968]Lattice parametersa=6.088±.003,b=7.033±.002,c=7.031±.002JL,p= 95.73°±.04° [ibid.]Density(calculated) 1.060 g/cm3Thermal parameters[ibid.]Isotropic: H 6.00 [ibid.]Cl 5.68N 5.04C(l) 6.08C(2) 7.56Scattering factorsH°, C° . N°, Cl~ [3.3.1A]Scale factor(integrated intensities) 0.5674 x 10 4ReferenceLindgren, J. and I. Olovsson (1968). ActaCryst. B24, 554.d(A)6.0544.9574.5PO3.9763.7113.5153.4983.1313.0423.0292.9062. 8902.6412. 7812.7402.6852.6712.5072.4792.4122.3542.2952.2402.2222. IPS2.1462.1032.0181.9891.9411.8851.8741 .8541.R251.8201.7651.7581 .7511.7491.677Calculated Pattern (Peak heights)/3113

Trimethylammonium Chloride, (CH 3 ) 3 NHCI « continuedd(A)6*0584.9604.5^03.9783.7113.5163.1*983.1423.1323.0413.0292,9062.8892.8872.8422.7822.7392.6*62.6842.6702.5072.4802.4122.3542.2^52.2402.2232.1862.1842.1462.1332.1092.0131.9891.9411.8971.8R51.6741.8541.8261.8201.7711.7651.7581.7511.7491.677Calculated Pattern (Integrated)7 hkl1 0 o 41 -1 1 47 loo10 1 11001 04 -1 11 1 11-4 4^ 1 4 020002021012101 2. 0Q 200?1 0 22? -1 1 21 -201ft -1 2 11 2 1 0«1 2 171 1 2b 2 0 1f> -2111 2 1 15 0223 -2 0 21 -122p 2 ? 021 2 22 0 3 121 3 0? 2021 -1 1 31 2212 -13111 1 1 3-2 2 22 3 1 01 -1231 -1321 -2 1 31 2301 3 1 11 -2 3 11 *3 1 21 2031 0401 32028(°)A = 1.54056 A14.6117.87IP. 3?22.3323.96^5.3125.4428.3828.4829.3429.4730.7430. Q230.9531.4632.1532.6633.3333.3633.5335. 7P36.1937.2538.20•^9.2240.2?40.5541.2641. 3P42. OR42.3342.8544.8745.5746.7747.9143.2543.5549.1049.9150.0851.5751.7751.9652.1952.2654.68114

CUMULATIVE INDEX TO CIRCULAR 539, VOLUMES 1, 2, 3, 4, 5, 6,7, 8, 9, 10, MONOGRAPH 25, SECTIONS 1, 2, 3, 4, 5, 6, 8, and 9s4—Acetyl-2 '-fluorobiphenyl, C 14HnOF .....4-Alanine, C 3H7O 2N ......................Aluminum, Al ............................Aluminum antimony, AlSb..................Aluminum calcium sulfate hydrate (ettringite),Al 20 3-6Ca0.3S0 3 .31H 20.............Aluminum chloride, A1C1 3 .................Aluminum chloride hexahydrate (chloraluminite),A1C1 S -6H 5O ..................Aluminum fluosilicate, topaz, Al 2SiO 4(F,OH) 2Aluminum metaphosphate, A1(PO 3 ) 3 .........Aluminum nickel, AINi ....................Aluminum orthophosphate (berlinite), A1PO 4(trigonal)..............................Aluminum orthophosphate, A1PO4 (orthorhombic)..............................Aluminum oxide, (corundum), alpha A1 2O, .....Aluminum oxide monohydrate (bohmite), alphaA120 3-H 20 .............................Aluminum oxide monohydrate, diaspore, betaA1203 -H 20 .............................Aluminum silicate (mullite) 3Al 2O 3 -2SiO 2 ....Ammonium acetate, NH 4-CH 3CO 2 ...........Ammonium aluminum fluoride, (NH 4 )3A1F 6 ....Ammonium aluminum selenate hydrate,NH4A1 (Se04 ) 2.12H20 ...................Ammonium aluminum sulfate dodecahydrate(tschermigite), NH 4A1(SO 4 ) 3 .12H 2O ........Ammonium azide, NH 4N 3 ...................Ammonium bicarbonate (teschemacherite),(NH4)HC0 3 ............................Ammonium bromide, NH 4Br.................Ammonium bromoosmate, (NH 4 ) 2OsBr6 .......Ammonium bromoplatinate, (NH 4 ) 3PtBrfi ......Ammonium bromoselenate, (NH4 )2SeBr6 ......Ammonium bromotellurate, (NH4 ) 2TeBr6 ......Ammonium cadmium sulfate, (NH 4),Cd?(SOAAmmonium cadmium sulfate hydrate,(NH 4 )2Cd(SO 4 ) 2 .6H 2O ...................Ammonium cadmium trichloride, NH4CdCl 3 . . .Ammonium calcium sulfate, (NH 4 )2 Ca2 (SO 4)3Ammonium chloride (sal-ammoniac), NH 4C1. . .Ammonium chloroiridate, (NH4),IrCl rt ........Ammonium chloroosmate, (NH 4 ) 2OsCl ft .......Ammonium chloropalladate, (NH4 ) 2PdCl fi .....Ammonium chloropalladite, (NH 4 ) 2PdCl 4 .....Ammonium chloroplatinate, (NH 4),PtCl A ......Ammonium chlorostannate (NH 4 ) 2SnCl o .......Ammonium chlorotellurate, (NH 4 ) 2TeCl 6 ......Ammonium chromium sulfate dodecahydrate,NH4Cr(S04)2 .12H 20 .....................Ammonium cobalt fluoride, NH4CoF 3 ........Ammonium cobalt (II) trichloride, NH4 CoCl 3Ammonium copper chloride, NH 4CuCl,.......Ammonium copper chloride hydrate,(NH4)2CuCl 4.2H 20 .......................Ammonium dihydrogen phosphate, NH 4H 2PO4Ammonium fluoberyllate, (NH 4 ) 2BeF 4 ........Ammonium fluoborate, NH4BF4 .............Vol. orsec.8m8m1489m71m2m6m1010933m8m9m9m699239887m8m5m8mi3,T18655868m6m7m9m43m3mPage91931172'Further work on this program is in progress, and it is anticipated that additional sections will be issued. Therefore, the accumulative index here is not necessarily the concluding index forthe project.m—Monograph 25.A mineral name in ( ) indicates a synthetic sample.36134382433841395534549716455567596676348795786456Vol. orsec. PageAmmonium fluogermanate, (NH 4 )2GeF ft ....... 6 8Ammonium fluosilicate (cryptohalite),(NH4) 2SiF 6 ............................. 5 5Ammonium gallium sulfate dodecahydrate,NH 4Ga(SO4)2 - 12H 2O ..................... 6 9Ammonium iodide, NH 41 ................... 4 56Ammonium iron fluoride, (NH 4 ) 3FeF ft ........ Ammonium iron sulfate dodecahydrate,9m 9NH4Fe(S04)2 - 12H 20 ..................... 6 10Ammonium magnesium chromium oxide hydrate,(NH 4 )2Mg(CrO 4 ) 2 -6H 2O ................. 8m 10Ammonium manganese sulfate, (NHA Mn, (SO*), Ammonium manganese sulfate hydrate,7m 8(NH 4) 2Mn(SO 4) 2.6H 2O .................. 8m 12Ammonium manganese(II) trifluoride, NH4MnF 3 5m 8Ammonium mercury chloride, NH 4HgCl 3(revised) ............................. Ammonium metavanadate, NH4 VO 3 .......... 8m 8 149Ammonium nickel chromium oxide hydrate,(NH 4) 2Ni(Cr0 4V6H 20 ................... Ammonium nickel (II) trichloride, NH4NiCl 3 8m 6m 166Ammonium nitrate (ammonia-niter), NH 4NO 3 . . 7 4Ammonium oxalate monohydrate (oxammite),(NH4 ) 2C 204 .H 20 ........................ 7 5.Ammonium perchlorate, NH 4C1O 4 (orthorhombic).............................. 7 6Ammonium perrhenate, NH4ReO 4 ............ 9 7Ammonium phosphomolybdate tetrahydrate,(NH4 ) sP0 4(MoO s ) 12.4H 20. . ............... 8 10Ammonium sulfate (mascagnite), (NH 4 ) 2SO4(revised) .............................. 9 8Ammonium yttrium oxalate hydrate,NH 4Y(C 20 4 )2 .H 20 ....................... 8m 97Ammonium zinc fluoride, NH 4ZnF 3 ......... 8m 18Ammonium zirconium fluoride, (NH4 ) sZrF7 .... 6 14Antimony, Sb ............................ 3 14Antimony(III) fluoride, SbF 3 ................ 2m 4Antimony(IU) iodide, Sbl s .................. 6 16Antimony(III) oxide (senarmontite), Sb 2O s(cubic).... ............................ Antimony(III) oxide, valentinite, Sb 2Os3 31(orthorhombic) ......................... 10 6Antimony(IV) oxide (cervantite), Sb 2O4 ...... 10 8Antimony(V) oxide, Sb 2O s ................. 10 10Antimony scandium, SbSc.................. 4m 44.Antimony selenide, Sb 2Se 3 ................. 3m 7Antimony (in) sulfide (stibnite), Sb2Ss ....... 5 6Antimony telluride, Sb 2Te s ................. 3m 8Antimony terbium, SbTb ................... 5m 61Antimony thorium, SbTh ................... 4m 44Antimony thulium, SbTm................... 4m 45Antimony ytterbium, SbYb ................. 4m 45Antimony yttrium, SbY .................... 4m 46Arsenic acid, H s As sO lo ................... 7m 84Arsenic, As ............................. 3 6Arsenic(III) iodide, AsI3 ................... 6 17Arsenic trioxide (arsenolite), As 2O, (cubic) . . Arsenic trioxide, claudetite, As2O s (monoclinic)1 51................................ 3m 9't—Ascorbic acid, CgHiO 6 ................. 8m 99Azobenzene, C 12H 16N 2 .................... 7m 86Barium aluminum oxide, BaAl,O 4 ........... 5m 11Barium arsenate, Ba 3(AsO4)2 ............... 2m 6Barium, Ba .............................. 4 7Barium borate, BaB.O,.................... Barium boron oxide, high form, BaB 2O 4 ..... 7m 4m 104115

CUMULATIVE INDEX—ContinuedBarium boron oxide, BaB4O 7 ...............Barium bromate hydrate, Ba(BrO 3 ),-H 2O .....Barium bromide monohydrate, BaBr2 -H 2O.....Barium calcium tungsten oxide, Ba 2CaWO 6 . ..Barium carbonate (witherite), BaCO s (orthorhombic)..............................Barium carbonate, BaCO s(cubic) at 1075 °C . .Barium chlorate hydrate, Ba(Clo 3 ) 2 -H 2O .....Barium chloride, BaCl 2 , (orthorhombic) ......Barium chloride, BaCl 2 , (cubic) ............Barium fluoride, BaF 2 .....................Barium fluosilicate, BaSiFft ................Barium molybdate, BaMoO4 ................Barium nitrate (nitrobarite), Ba(NO a ) 3 .......Barium oxide, BaO .......................Barium perchlorate trihydrate, Ba(ClO 4)2-3H 2OBarium peroxide, BaO 2 ....................Barium selenide, BaSe ....................Barium stannate, BaSnO, ..................Barium sulfate (barite), BaSO 4 .............Barium sulfide, BaS ......................Barium titanate, BaTiO,...................Barium titanium silicate (fresnoite),Ba aTiSi aO s ............................Barium tungstate, BaWO 4 ......... ........Barium zirconate, BaZrO 3 .................Beryllium, alpha, Be ......................Beryllium aluminum oxide (chrysoberyl),BeAl 20 4 ...............................Beryllium aluminum silicate, beryl,Be,Al 2(SiO s )« ..........................Beryllium calcium oxide, Be,,Ca,.,O,* .......Beryllium chromium oxide, BeCr 2O 4 .........Beryllium cobalt, BeCo ...................Beryllium germanate, Be 2GeO 4 .............Beryllium lanthanum oxide, Be 2 La 2Os .......Beryllium niobium, Be,Nb..................Beryllium orthosilicate, phenacite, BeSi 2O4 .,Beryllium oxide (bromellite), BeO ..........Beryllium palladium, BePd ................Bis (o-dodecacarborane), C4 B20H22 ..........Bismuth, Bi .............................Bismuth cerium. BiCe ....................Bismuth dysprosium, BiDy .................Bismuth erbium, BiEr .....................Bismuth fluoride, BiF, ....................Bismuth holmium, BiHo ...................Bismuth(III) iodide, Bil s ...................Bismuth lanthanum, BiLa..................Bismuth neodymium, BiNd .................Bismuth orthophosphate, BiPO4 (monoclinic)Bismuth orthophosphate, BiPO4 (trigonal)....Bismuth orthovanadate, low form, BiVO4(tetragonal)............................Bismuth orthovanadate, high form, BiVO4(monoclinic)...........................Bismuth oxybromide, BiOBr................Bismuth oxychloride (bismoclite), BiOCl ....Bismuth oxyiodide, BiOI ..................Bismuth praseodymium, BiPr...............Bismuth sulfide (bismuthinite), Bi2S3 (revised)Bismuth telluride, BiTe ...................Bismuth telluride (tellurobismuthite), Bi2Te,m—Monograph 25-A mineral name in ( ) indicates a synthetic sample,Vol. orsec.4m8m3m9m2108m9m9m14m719m2m65m3m3739m759m997m105m109m7m815m6m34m4m4m1m4m64m4m3m3m3m3m8494m5m4m3mVol. orPage sec. Page6 Bismuth trioxide (bismite), alpha Bi 2O 3...... 3m 1619 Cadmium, Cd ............................ 3 1010 Cadmium bromide, CdBr2 .................. 9 1710 Cadmium carbonate (otavite), CdCO 3 ........ 7 11Cadmium cerium, CdCe.................... 5m 6354 Cadmium chloride, CdCl 2 .................. 9 1811 Cadmium chromite, CdCr2O4 ................ 5m 1621 Cadmium cyanide, Cd(CN) 2 ................ 2m 811 Cadmium imidazole nitrate,13 Cd(C sH 4N 2 )6(N0 3 )2 ..................... 8m 2370 Cadmium iron oxide, CdFe 2 O 4 .............. 9m 167 Cadmium lanthanum, CdLa................. 5m 637 Cadmium molybdate, CdMoO 4 ............... 6 2181 Cadmium nitrate tetrahydrate,63 Cd(NCM.,'4H,O ........................ 7m 937 Cadmium oxide, CdO...................... 2 2718 Cadmium oxide, CdO (ref. standard) ........ 8m 261 Cadmium perchlorate hexahydrate,11 Cd(C104 )2 .6H 20 ........................ 3m 1965 Cadmium praseodymium, CdPr.............. 5m 648 Cadmium selenide, CdSe (hexagonal)........ 7 1245 Cadmium sulfate, CdSO 4 ................... 3m 20Cadmium sulfate hydrate, 3CdSO4 «8H2O ..... 6m 814 Cadmium sulfate monohydrate, CdSO4 *H2O ... 6m 109 Cadmium sulfide (greenockite), CdS......... 4 158 Cadmium telluride, CdTe .................. 3m 2164 Cadmium tungstate, CdWO 4 ................ 2m 8Calcium, Ca .............. .............. 9m 6810 Calcium aluminate, 12CaO-7;Al,O, .......... 9 20Calcium aluminum germanate, Ca 3Al 2(GeO 4 ) 3 10 1513 Calcium bromide hexahydrate, CaBr2 -6H2O ... 8 1589 Calcium carbonate (aragonite), CaCO 312 (orthorhombic) ......................... 3 5362 Calcium carbonate (calcite) CaCO 3 (hexagonal) 2 5113 Calcium chromate, CaCrO4 ................. 7 1365 Calcium chromium germanate, Ca3Cr 2(GeO4 ) 3 10 1692 Calcium chromium silicate (uvarovite),11 CasCr2(Si04 ) 3 .......................... 10 1736 Calcium fluoride (fluorite), CaF 2 ........... 1 6962 Calcium fluoride phosphate (fluorapatite),7 Ca s F(PO 4 ) 3 ............................ 3m 2220 Calcium formate, Ca(HCO 2 ) 2 ............... 8 1646 Calcium gallium germanate, Ca3Ga2(GeO4 ) 3 . . . 10 1847 Calcium hydroxide (portlandite), Ca(OH)2 .... 1 5847 Calcium iron germanate, CasFe,(GeO4),...... 10 197 Calcium iron silicate (andradite),48 Ca3Fe 2 Si 3Q 2 ........................... 20 Calcium magnesium silicate (diopside),9 2248 CaMg(SiO s ) 2 ........................... 5m 1749 Calcium molybdate (powellite), CaMoO 4 ..... 6 2211 Calcium nitrate, Ca (NO S ) 2 ................. 7 141.3 Calcium oxide, CaO ...................... 1 43Calcium phosphate, beta-pyro-, Ca,P,O7 ..... 7m 9514 Calcium selenide, CaSe ................... 5m 64Calcium sulfate (anhydrite), CaSO 4 ......... 4 6514 Calcium sulfide (oldhamite), CaS ........... 7 1514 Calcium telluride, CaTe................... 4m 5054 Calcium titanium oxide (perovskite),16 CaTi0 3 .............................. 9m 1749 Calcium tungstate, scheelite, CaWO 4 ........ 6 2313 Calcium tungsten oxide, Ca 3WO6 ........... 9m 1950 tri-Calcium aluminate, 3CaO-Al 2O 3 .......... 5 1016 Carbon, diamond, C....................... 2 5Cerium, antimony CeSb.................... 4m 40Cerium arsenate, CeAsO 4 .................. 4m 8Cerium arsenide, CeAs.................... 4m 51116

CUMULATIVE INDEX—ContinuedCerium(III) chloride, CeCl 3 ..............Cerium copper, CeCu*....................Cerium(III) fluoride, CeF a . ...............Cerium magnesium, CeMg .. .............Cerium magnesium nitrate 24-hydrate,Ce 2Mg3(N0 3 ) l2 -24H20 ..................Cerium niobium titanium oxide (eschynite),CeNbTi0 6 ...........................Cerium nitride, CeN ....................Cerium(IV) oxide (cerianite), CeO,........Cerium phosphide, CeP .................Cerium(III) vanadate, CeVO 4 .............Cerium zinc, CeZn .....................Cesium aluminum sulfate dodecahydrate,CsAl(S0 4V 12H 20 ....................Cesium beryllium fluoride, CsBeF 3 .......Cesium bromate, CsBrO s ................Cesium bromide, CsBr ......... ... .... ...Cesium bromoosmate(IV), Cs 2OsBr6 .......Cesium bromoplatinate, Cs 2PtBr6 .........Cesium bromoselenate, Cs 2SeBr6 .........Cesium bromotellurate, Cs2TeBr 6 .........Cesium cadmium trichloride, CsCdCl 3(hexagonal)...........................Cesium calcium fluoride, CsCaF 3 .........Cesium calcium sulfate, Cs,Ca,(SQJ,......Cesium calcium trichloride, CsCaCl 3 ......Cesium cerium chloride, Cs9CeCl ft . ........Cesium chlorate, CsCIO, ................Cesium chloride, CsCl ..................Cesium chloroosmate(IV), Cs 2OsCl 6 .......Cesium chloroplatinate, Cs 2PtCl rt ..........Cesium chlorostannate, Cs 2SnCl 6 .........Cesium chromate, Cs 2CrO4 ...............Cesium chromium sulfate dodecahydrate,CsCr(S0 4 )2 - 12H 20 .....................Cesium cobalt (II) trichloride, CsCoCl 3 ....Cesium copper sulfate hexahydrate,Cs,Cu(SO 4V6H,O.....................Cesium copper(II) trichloride, CsCuCl 3 .....Cesium dichloroiodide, CsICl 2 ............Cesium fluoantimonate, CsSbF ft ..........Cesium fluoborate, CsBF4 ................Cesium fluogermanate, Cs2GeF 6 ...........Cesium fluoplatinate, Cs^PtF, ............Cesium fluoride, CsF ....................Cesium fluosilicate, Cs2SiF6 .............Cesium gallium sulfate dodecahydrate,CsGa(S0 4V 12H 20 .....................Cesium iodine bromide, CsI,Br............Cesium iodide, Csl ......................Cesium iron sulfate dodecahydrate,CsFe(S04 )2 . 12H 20 .....................Cesium iron sulfate hexahydrate,Cs,Fe(SO.V6H,0.....................Cesium lead fluoride, CspbF 3 ............Cesium lead(II) trichloride, CsPbCl 3(tetragonal)...........................Cesium lithium fluoride, CsLiF2...........Cesium magnesium chromium oxide,Cs 2Mg 2(CrO 4) 3 ........................Cesium magnesium chromium oxide hydrate,Cs 2Mg(CrO4)2 '6H 2O ....................m—Monograph 25.A mineral name in ( ) indicates a synthetic sample.Vol. orsec.1m7m85m103m4m14m1m5m69m832m8895m8m7m5m7m822m553m86m7m5m34m8563m587m467m8m5m7m8m8mVol. orPage sec. Page8 Cesium magnesium sulfate hexahydrate,99 Cs 2Mg(SO 4),-6H 7O. ...................... 7m 1817 Cesium manganese sulfate hexahydrate,65 Cs,Mn(SOJ,-6H,O...................... 7m 20Cesium mercury chloride, CsHgCl, ......... 7m 2220 Cesium nickel sulfate hexahydrate,Cs,Ni(SQJ,'6H,0 ...................... 7m 2324 Cesium nickel (II) trichloride, CsNiCl, ...... 6m 1251 Cesium nitrate, CsNO 3 .................... 9 2555 Cesium perchlorate, CsClO4 , (orthorhombic) 1m 1052 Cesium strontium trichloride, CsSrCl 3 ....... 6m 1.39 Cesium sulfate Cs 2 SO 4 .................... 7 1765 Cesium vanadium sulfate dodecahydrate,CsV(S0 4 )2 -12H 20 ....................... 1m 1125 Cesium zinc sulfate hexahydrate,69 18 Cs,Zn(SO,),-6H,0. ..................... Chromium, Cr ............................ 7m 5 252049 10 Chromium fluoride, Cr,F,.................. Chromium(III) fluoride trihydrate, CrF 3 -3H 2O 7m 5m 1082519 Chromium iridium 3:1, Crjr ................ 6m 1420 Chromium orthophosphate, alpha, CrPO 4 ..... 2m 1224 Chromium orthophosphate, beta, CrPO 4 ...... 9 26Chromium(III) oxide, Cr 2O3 ................. 5 2219 Chromium rhodium 3:1, Cr3 Rh .............. 6m 1525 Chromium silicide, Cr 3Si .................. 6 2912 Cobalt, Co (cubic)........................ 4m 1021 Cobalt aluminum oxide, CoAl 2O4 ............ 9 27!01 Cobalt antimony oxide, CoSb 2O6 ............ 5m 2620 Cobalt arsenide (skutterudite), CoAs 3 ....... 10 2144 Cobalt(II) carbonate (spherocobaltite),11 CoCO 3 ................................ 10 2414 Cobalt chromium oxide, CoCr 2 O4 ........... 9m 2116 Cobalt diarsenide, CoAs 2 (revised) ......... 4m 1025 Cobalt fluosilicate hexahydrate,CoSiF 6 .6H2O........................... 3m 272i Cobalt gallate, CoGa2 O 4 ................... 10 2711 Cobalt germanate, Co 2 GeO4 ................ 10 27Cobalt iodide, CoI2 ....................... 4m 5214 Cobalt iron arsenide (safflorite), CoFeAs 4 ... 10 2822 Cobalt iron oxide, CoFe 2 O 4 ................ 9m 2250 Cobalt mercury thiocyanate, Co[Hg(CNS)J ... 2m 139 Cobalt(II) oxide, CoO ..................... 9 2822 Cobalt(II, III) oxide, Co 3O4 ................ 9 2917 Cobalt perchlorate hexahydrate,27 Co(ClO 4 ) 2 .6H 2O ........................ 3m 2826 Cobalt silicate, Co 2 SiO 4 (orthorhombic). ..... 4m 1119 Cobalt sulfate, beta, CoSO 4 ................ 2m 14Cobalt Utanate, CoTiO, ................... 4m 1323 Cobalt tungstate, CoWO 4 .................. 4m 1310 3 Copper, Cu .............................. 1 1547 Copper antimony oxide, CuSb 2O 6 ............ 5m 27Copper(I) bromide, CuBr ................... 4 3628 Copper carbonate, basic, azurite,CU 3(OH) 2(C0 3 )2 ........................ 10 30lg Copper carbonate, basic, (malachite),26 CU 2(OH) 2C0 3 .......................... 10 31Copper (I) chloride (nantokite), CuCl ....... 4 3524 Copper glutamate dihydrate,105 CuC,H 7NO.-2H,0 ...................... 7m 110Copper(I) iodide (marchite), Cul ............ 4 3827 Copper (I) oxide (cuprite), Cu2O ............ 2 23Copper(II) oxide (tenorite), CuO ............ 1 4929 Copper phosphate, alpha-pyro-, Cu,P,O 7 . .... 7m 113Copper pyrazole chloride, Cu(C 3H 4N 2 )4Cl 2 ... 8m 31Copper sulfate (chalcocyanite), CuSO 4 ...... 3m 29Copper(II) sulfide (covellite), CuS .......... 4 13117

CUMULATIVE INDEX—ContinuedDibenzoy 1methane, C^H^O,...............Dysprosium antimony, DySb...............Dysprosium arsenate, DyAsO 4 .............Dysprosium arsenide, DyAs...............Dysprosium gallium oxide, Dy 3Ga 7(GaO 4) 3 ...Dysprosium nitride, DyN .................Dysprosium sesquioxide, Dy 2 O 3 ...........Dysprosium telluride, DyTe................Dysprosium vanadate, DyVO 4 .............Erbium antimony, ErSb ...................Erbium arsenate, ErAsO4 ..................Erbium arsenide, ErAs ....................Erbium gallium oxide, Er 3Ga2(GaO 4} 3 ........Erbium manganite, ErMnO, ................Erbium nitride, ErN .......................Erbium phosphate, ErPO 4 ..................Erbium sesquioxide, Er2O 3 .................Erbium telluride, ErTe ....................Erbium vanadate, ErVO 4 ...................Europium arsenate, EuAsO 4 ................Europium(III) chloride, EuCl 5 ..............Europium gallium oxide, Eu,Ga 2(GaO 4) s . .....Europium nitride, EuN ....................Europium oxide, EuO .....................Europium oxychloride, EuOCl ..............Europium(III) vanadate, EuVO 4 .............Gadolinium antimony, GdSb ................Gadolinium arsenate, GdAsO 4 ..............Gadolinium arsenide, GdAs ................Gadolinium chloride hexahydrate,GdCl,-6H,O...........................Gadolinium fluoride, GdF 3 .................Gadolinium gallium oxide, Gd 3Ga2(GaO 4) s ....Gadolinium indium, Gdln ..................Gadolinium nitride, GdN ...................Gadolinium oxide, Gd2 O, ..................Gadolinium oxychloride, GdOCl ............Gadolinium titanium oxide, Gd 2TiO s ........Gadolinium vanadate, GdVO 4 ...............Gallium, Ga .............................Gallium antimonide, GaSb ................ .Gallium arsenide, GaAs ...................Gallium oxide, alpha, Ga2O 3 ...............Gallium phosphate hydrate, GaPO4 -2H 2O ....Gallium phosphate («-quartz type), GaPO4 . .. .Germanium, Ge ........................ ...Germanium dioxide, GeO 2 (hexagonal)(low form) .............................Germanium dioxide, GeO 2 (tetragonal)(high form) ............................Germanium iodide, GeI2 ...................Germanium(IV) iodide, GeI4 ................Glyoxime, H 2C 2(NOH) 2 ..................Gold, Au ................................Gold antimony 1:2 (aurostibite), AuSb 2 ......Gold(I) cyanide, AuCN ....................Gold dysprosium, AuDy ...................Gold holmium, AuHo ......................Gold magnesium, AuMg....................Gold niobium 1:3, AuNb, ..................Gold potassium cyanide, AuK(CN) 2 .........Gold tin, 1:1 AuSn. .......................Gold titanium 1:3, AuTi 3 ..................m—Monograph 25.A mineral name in ( ) indicates a synthetic sample.Vol. orsec.7m4m3m4m2m4m94m4m4m3m4m1m2m4m984m5m3m1m2m4m4m1m4m4m4m4m7m1m2m5m4m1m1m8m5m263m48m81184m58m17105m5m6m6m8m76mPage11541305315533054154131541216553125552932131756561316421757118141867571617323093033253427185128582510233183366688316361917Gold vanadium 1:3, AuV 3 .........Hafnium, Hf ....................Hexam ethyl en ediammonium adipate,Holmium arsenate, HoAsO4 ................Holmium ethylsulfate nonahydrate,Hot(CaH § )SOj s -9H aO ....................Holmium nitride, HoN .....................Holmium selenide, HoSe ...................Holmium sesquioxide, Ho2O 3 ...............Holmium vanadate, HoVO4 .................Hydrogen borate, beta, HBO 2 ...............Hydrogen iodate, HI 3O 8 ...................Hydroquinone, gamma, C 6H 6O 2 .............Imidazole nickel nitrate, (C,H4N,) ANi(NO,),. .Imidazole zinc chloride, (C,H4N 2 ) 2 ZnCl, ....Indium, In ...............................Indium antimony, InSb .....................Indium arsenide, InAs .....................Indium oxide, In 2 O 3 .......................Indium phosphate, InPO 4 ..................lodic acid, HIO 3 ..........................Iodine, I 2 ................................Iridium , Ir ...............................Iridium dioxide, IrO 2 ......................Iridium niobium 1: 3, IrNb3 .................Iridium titanium 1:3, IrTi 3 .................Iridium vanadium 1:3, IrV3 .................Iron, alpha Pe ...........................Iron arsenide, FeAs ......................Iron arsenide (loellingite), FeAs 2 ...........Iron bromide, FeBr2 .......................Iron iodide, FeI2 .........................Iron(II,III) oxide (magnetite), Fe 3O4 .........iron sulfate hydrate (melanterite), FeSO 4 -7H 2OIron sulfide (pyrite), FeS2 .................bis-(N-lsopropyl-3-ethylsalicylaldiminato)palladium, (C f ,H fRNO),Pd. ...............Lanthanum antimony, LaSb ................Lanthanum arsenate, LaAsO4 ..............Lanthanum arsenide, LaAs ................Lanthanum borate, LaBO, .................Lanthanum chloride, LaCl a ................Lanthanum fluoride, LaF 3 .................Lanthanum magnesium, LaMg ..............Lanthanum magnesium nitrate 24-hydrate,La2Mg 3(NO 3 ) 12 .24H 20 ....................Lanthanum niobium titanium oxide, LaNbTiOfiLanthanum nitrate hydrate, La(NO 3 ) 3 *6H 2O ...Lanthanum nitride, LaN ...................Lanthanum oxide, La2 O 3 ...................Lanthanum oxychloride, LaOCl .............Lanthanum phosphide, LaP ................Lanthanum selenide, LaSe .................Lanthanum zinc, LaZn ....................Lead, Pb ................................Lead boron oxide, PbB4O 7 .................Lead bromide, PbBr2 ......................Lead carbonate (cerrussite), PbCO 3 .........Lead chloride (cotunnite), PbCl 2 ...........Lead formate, Pb(HCO 2 )2 ..................Lead fluochloride (matlockite), PbPCl ......Lead fluoride, alpha PbP2 (orthorhombic) ....Lead fluoride, beta PbF2 (cubic) ...........Lead(II) iodide, Pbl, ......................Lead molybdate (wulfenite), PbMoO4 ........Vol. orsec.. 6m. 37m3m1m4m4m94m9m8m8m7m7m343m585344m6m6m6m41m104m4m5m8m57m4m3m4m1m1m75m1m3m8m4m375m4m5m14m222815557Page1818121341858593218711041072712312733526292816919192021319345960313829144423660202021692237406133226961703419475645307631333423118

CUMULATIVE INDEX—ContinuedVol. orsec.PageLead monoxide (litharge), PbO (red) tetragonal .................................. 2 30Lead monoxide (massicot), PbO (yellow)(orthorhombic) ......................... 2 32Lead nitrate, Pb(NOs )2 .................... 5 36Lead(U, .III) oxide (minium), PbsO 4 .......... 8 32Lead oxybromide, Pb3O 2Br2 ................ 5m 32Lead phosphate hydrate, Pb 5 (PO4 ) sOH ...... 8 33Lead selenide (clausthalite), PbSe ......... 5 38Lead sulfate (anglesite), PbSO, ............ 3 67Lead sulfide (galena), PbS ................ 2 18Lead titanate, PbTiO s .................... 5 39Lead tungstate (stolzite), PbWO4 (tetragonal)(revised) .............................. 5m 34Lead uranium oxide, pb 3UO 6 ............... 8m 109Lithium aluminum fluoride, alpha, Li 3AlF fi ...Lithium arsenate, Li 3 AsO4 .................8m2m11119Lithium azide, LiN 3 ......................Lithium barium trifluoride, LiBaF,..........8m5m11335Lithium beryllium fluoride, Li,BeFA. ........Lithium borate, Li 2B 4O 7 ..................7m8m126114Lithium bromide, LiBr .................... 4 .30Lithium carbonate, Li2CO 3 ................Lithium chloride, LiCl ....................8m14262Lithium fluoride, Li F ..................... 1 61Lithium iodate, LiIO 3 ..................... 7 26Lithium molybdate, Li 2 MoO 4 (trigonal)....... 1m 23Lithium niobate, LiNbO 3 .................. 6m 22Lithium nitrate, LiNO, .................... 7 27Lithium oxide, Li 2O ...................... 1m 25Lithium perchlorate trihydrate, LiClO4 .3H 7O 8 34Lithium phosphate, low form (lithiophosphate),Li 3PO 4 (orthorhombic) revised ..... 4m 21Lithium phosphate, high form, Li 3PO 4 ....... 3m 39Lithium rubidium fluoride, LiRbF,..........Lithium sodium aluminum fluoride,7m 128cryolithionite, Li 3Na 3Al2F 12 ............. 9m 23Lithium sodium sulfate, LiNaSO4 ........... 6m 24Lithium sulfate, Li 2 SQ 4 ................... 6m 26Lithium sulfate monohydrate, Li2 SO4-H 2O .... 4m 22Lithium trimetaphosphate trihydrate,Li sP 3O,.3H2O .......................... 2m 20Lithium tungstate, Li2 WO4 (trigonal) ........ 1m 25Lithium tungstate hemihydrate, Li 2 WO4.y2H 2O 2m 20Lithium uranium fluoride, LiUF, ...........Lutetium arsenate, LuAsO4 ................7m5m13136Lutetium gallium oxide, LuaGa,(GaOJ, ...... 2m 22Lutetium manganite, LuMnO 3 ............... 2m 23Lutetium nitride, LuN..................... 4m 62Lutetium oxide, Lu2O, .................... 1m 27Lutetium vanadate, LuVO4 ................. 5m 37Magnesium, Mg........................... 1 10Magnesiun aluminum oxide (spinel),MgAl2 O 4 (revised) ...................... 9m 25Magnesium aluminum silicate (pyrope),Mg,Al2(Si04 ) 3 .......................... 4m 24Magnesium aluminum silicate (low cordierite),Mg^Al 4Si g O 18 (orthorhombic)........ 1m 28Magnesium aluminum silicate (high cordierite),Mg2Al 4Si s O 18 (hexagonal) .......... 1m 29Magnesium ammonium phosphate hexahydrate(struvite), MgNH 4PO 4-6H2O.......... 3m 41Magnesium boron oxide, Mg2B 2O 5 (triclinic) . . 4m 25m—Monograph 25.A mineral name in ( ) indicates a synthetic sample.Vol. orsec.PageMagnesium bromide, MgBr2 ................. 4m 62Magnesium carbonate (magnesite), MgCO,.... 7 28Magnesium chloride dodecahydrate,MgCl,*12H,O. .........................Magnesium chromite (picrochromite),7m 135MgCr2O4 ............................... 9 34Magnesium fluoride (sellaite), MgF 2 ......... 4 33Magnesium gallate, MgGa,O4 ............... 10 36Magnesium germanate, MgjGeC^ (cubic)...... 10 37Magnesium germanate, Mg2 GeO4 (orthorhombic).............................. 10 38Magnesium hydrogen phosphate trihydrate,newberyite, MgHPO,-3H,O ..............Magnesium hydroxide (brucite), Mg(OH)2 .....7m613930Magnesium molybdate, MgMoO,.............Magnesium oxide (periclase), MgO ..........7m12837Magnesium perchlorate hexahydrate,Mg(C10J,-6H,0 ....................... 7m 30Magnesium phosphate, alpha, Mg 2 P 2 O 7 ...... 9m 73Magnesium selenide, MgSe................. 5m 70Magnesium selenite hydrate, MgSeo 3'6H 2o ...Magnesium silicate, enstatite, MgSiO 3 .......8m611632Magnesium silicate (forsterite), Mg 2SiO4 ..... 1 83Magnesium silicate fluoride (norbergite),MgaSiO,-MgF 2 .......................... 10 39Magnesium silicate fluoride (humite),3Mg2 SiO4 -MgF 2 .........................Magnesium sulfate heptahydrate (epsomite),1m 30MgS0 4 .7H 20 ........................... 7 30Magnesium sulfide, MgS ................... 7 31Magnesium sulfite hydrate, MgSO s .6H2O ..... 9m 26Magnesium tin, Mg 2 Sn ..................... 5 41Magnesium titanate (geikielite), MgTiO, ..... 5 43Magnesium tungstate, MgWO 4 ............... 1 84Manganese, alpha, Mn. ....................Manganese aluminate (galaxite), MnAl 2O4 ....7m914235Manganese bromide, MnBr2 ................. 4m 63Manganese(II) carbonate (rhodochrosite),MnC0 3 ................................ 7 32Manganese chloride (scacchite), MnCl 2 ...... 8m 43Manganese chloride hydrate, MnCl2.4H 2 O .... 9m 28Manganese cobalt oxide, MnCo,O 4 ..........Manganese ferrite (jacobsite), MnFe 2O4 ......9m93036Manganese iodide, Mnl 2 ................... 4m 6.3Manganese(II) oxide (manganosite), MnO ..... 5 45Manganese(III) oxide (partridgeite), Mn 2O 3 ... 9 37Manganese selenide, MnSe................. 10 41Manganese sulfide (alabandite), alpha MnS. . . 4 11Manganese(II) tungstate (huebnerite), MnWO 4 2m 24Manganese vanadiun oxide, Mn2V 2 O 7 ........ 9m 75Mercury(I) bromide, Hg 2Br2 ................. 7 33Mercury(I) chloride (calomel), Hg 2Cla ........ 1 72Mercury(ll) chloride, HgCl 2 ................ 1 73Mercurydl) cyanide, Hg(CN)2 ............... 6 35Mercury(II) fluoride, HgF 2 ................. 2m 25Mercury(I) iodide, Hgl..................... 4 49Mercury iodide, HgI 2 (tetragonal) (revised) ... 7m 32Mercury magnesium, HgMg ................. 6mMercurydl) oxide (montroydite) HgO (revised) 98439Mercury(II) selenide (tiemannite), HgSe ...... 7 35Mercurydl) sulfide (cinnabar), HgS (hexagonal) ............................... 4 17Mercury(II) sulfide (metacinnabar), HgS(cubic)................................ 4 21Mercury sulfide chloride, alpha, HgsS 2Cl 2 ....Metabolic acid, HBO 2 (cubic) ..............8m4m11827119

CUMULATIVE INDEX—ContinuedVol. orMethanesulfonanilide, C fiH 5 -NH-SO 2CH 3 ..... sec. Page9m 78N-methylphenazLnium tetracyanoquinodimethanide,C,, H,, N,.................... 7m 146Molybdenum, Mo.......................... 1 20Molybdenum disulfide (molybdenite), MoS2 ... 5 47Molybdenum osmium 3:1, Mo,Os ............ 6m 28Molybdenum trioxide (molybdite), MoO 3 ...... 3 302-Naphthylamine, n-phenyl-, C 1ftH 13N ....... 6m 29Neodymium antimony, NdSb ................ 4m 43Neodynium arsenate, NdAsO4 .............. 4m 28Neodymium arsenide, NdAs ................ 4m 64Neodymium borate, NdBO, ................. 1m 32Neodymium chloride, NdCl, ................ 1m 33Neodymium ethylsulfate nonahydrate,NdL(C 2H s )S0 4 ] 3 .9H 20 .................... 9 41Neodymium fluoride, NdP 3 ................. 8 36Neodymium gallium oxide, Nd 3 Ga2(GaO4 ) 3 .... 1m 34Neodymium oxide, Nd 7O, .................. 4 26Neodymium oxychloride, NdOCl ............ 8 37Neodymium selenide, NdSe ................ 5m 71Neodymium vanadate, NdVO 4 ............... 4m 30Neptunium nitride, NpN ................... 4m 64Nickel, Ni ............................... 1 13Nickel aluminate, NiAl 2O4 ................. 9 42Nickel arsenic 1:2 (rammelsbergite), NiAs 2 . . . 10 42Nickel arsenic sulfide (gersdorffite). NiAsS . . 1m 35Nickel(II) carbonate, NiCO 5 (trigonal) ....... 1m 36Nickel chloride, NiCl2 .................... 9m 81Nickel ferrite (trevorite), NiFe 2 O4 .......... 10 44Nickel fluosilicate hexahydrate, NiSiF6-6H 2O 8 38Nickel gallate, NiGa2O 4 ................... 10 45Nickel germanate, Ni 2 GeO4 ................ 9 43Nickel(II) oxide (bunsenite), NiO ........... 1 47Nickel phosphide, Ni 12 P 5 .................. 9m 83Nickel pyrazole chloride, Ni(C 3H 4N 2 ) 4Cl 2 .... 8m 44Nickel sulfate, NiSO4 ..................... 2m 26Nickel sulfate hexahydrate (retgersite),NiS0 4 -6H 20 ............................ 7 36Nickel sulfide, millerite, NiS .............. 1m 37Nickel tungstate, NiWO 4 ................... 2m 27Niobium osmium 3:1, Nb3Os................ 6m 30Niobium oxychloride, NbOCl,.............. 7m 148Niobium platinum 3:1, Nb 3Pt ............... 6m 31Niobium silicide, NbSi 2 ................... 8 39Osmium, Os ............................. 4 8Osmium titanium, OsTi.................... 6m 85Palladium, Pd ........................... 1 21Palladium hydride, PdH 0 . 70fi ................ 5m 72Palladium oxide, PdO ..................... 4 27Palladium vanadium 1:3, PdV 3 ............. 6m 32Phosphorus bromide, PBr 7 ................. Phosphorus oxide (stable form I), P2 O 5 ,7m 150(orthorhombic) ......................... 9m Phosphorus oxide (stable form II), P 2 O 5 ,86(orthorhombic) ......................... 9m 88Phosphorus oxide (metastable form), P4O 10 ,(rhombohedral) ....... ................. 9m 91Pimelic acid, C,H,,O, ................... 7m 153Platinum, Pt............................. 1 31Platinum titanium 1:3, PtTi 3 ............... 6m 33Platinum vanadium 1:3, PtV 3 ............... 6m 34Plutonium arsenide, PuAs ................. 4m 65Plutonium phosphide, PuP................. 4m 65m—Monograph 25.A mineral name in ( ) indicates a synthetic sample.Vol. orsec. PagePlutonium telluride, PuTe ................. 4m 66Potassium acid phthalate,C 6H4(COOH) (COOK) .................... 4m 30Potassium aluminum sulfate, KA1 (SO 4 ) 2 ..... 9m 31Potassium aluminum sulfate dodecahydrate,(alum), KA1(SO 4 )2 - 12H 2O ................. 6 Potassium barium nickel nitrite,36KaBaNi (N0 2 )6 ......................... 9m 32Potassium borohydride, KBH 4 .............. 9 44Potassium bromate, KBrO 3 ................. 7 38Potassium bromide, KBr ................... 1 66potassium bromide chloride, KBr 0. 5 Cl 0. 5 .... 8m 46Potassium bromoplatinate, K 2PtBr6 ......... 8 40Potassium bromoselenate, K,SeBrfi .......... 8 41Potassium cadmium fluoride, KCdP 3 ........ 8m 47Potassium cadmium sulfate, K,Cd, (SO 4), .... Potassium cadmium trichloride, KCdCl 3 ..... 7m 5m 3438Potassium calcium carbonate (fairchildite),K 2Ca(CO 3 )2 .......................... Potassium calcium chloride (chlorocalcite),8m 48KCaCl,............................... 7m 36potassium calcium fluoride, KCaF 3 ......... 8m 49Potassium calcium magnesium sulfate,K,CaMg(SO.),. ......................... 7m 37Potassium calcium nickel nitrite,K2CaNi(NO 2 ) fi .......................... 9m 33Potassium calcium sulfate, K,Ca, (SO 4),..... 7m 39Potassium chlorate, KC1O 3 ................ 3m 42Potassium chloride (sylvite), KC1 .......... 1 65Potassium chloroplatinate, K 2PtCl 6 ......... 5 49Potassium chlororhenate, K 3ReCl fi .......... 2m 28Potassium chlororuthenate(IV), K 2 RuCl 6 ..... 10 46Potassium chlorostannate, K 2SnCl fi ......... 6 38Potassium chromium sulfate dodecahydrate,KCr(S04 ) 2 -12H 20 ....................... 6 39Potassium cobalt (II) sulfate, K2Co 2 (SO4 ) 3 ... 6m 35Potassium cobalt (II) trifLuoride, KCoF 3 ..... 6m 37Potassium cobaltinitrite, K 3Co(NO 2 )6 ........ 9 45Potassium copper chloride, KCuCl^ ......... 7m 41Potassium copper chloride hydrate(mitscherlichite), K 2CuCl4.2H 2 O .......... 9m 34Potassium copper (II) trifluoride, KCuF3 ..... 6m 38Potassium cyanate, KCNO ................. 7 39Potassium cyanide, KCN ................... 1 77Potassium hydrogen diformate KH (HCOO) 2 .. 9m 93Potassium dihydrogen arsenate, KH^AsO4 .... 1m 38Potassium dihydrogen phosphate, KH 2PO4 ... Potassium fluogermanate, K2GeF 6 .......... 3 6 6941Potassium fluoplatinate, K2PtF6 ............ 6 42Potassium fluoride, KF ................... 1 6.4Potassium fluosilicate (hieratite), K 2SiF6 .... 5 50Potassium fluotitanate, K 2TiF fi ............. 7 40Potassium heptafluozirconate, K,ZrF7 ....... 9 46Potassium hydroxide, KOH at 300 °C ....... 4m 66Potassium hydroxy-chlororuthenate,K 4RU 2C1 I0O.H 20 ........................ 10 47Potassium iodide, KI ..................... 1 68Potassium iron cyanide, K 3Fe (CN) fi ........ 9m 35Potassium iron fluoride, K 3FeF 6 ........... 9m 37Potassium iron (II) trifluoride, KFeF3 ....... 6m 39Potassium lithium sulfate, KLiSO4 .......... ,3m 43potassium magnesium chloride hydrate(carnallite), KMgCl 3 -6H 2O ............... 8m 50Potassium magnesium chromium oxide,K 2Mg 2(Cr0 4 ) 3 ......................... 8m 52120

CUMULATIVE INDEX—ContinuedVol. orsec. PagePotassium magnesium sulfate (langbeinite),K2Mga (SO4 ) 3 ........................... 6m 40potassium magnesium sulfate hydrate(picromerite), K 2 Mg(SO 4 ) 2 -6H 2O .......... 8m 54Potassium magnesium trifluoride, KMgP 3 .... 6m 42Potassium manganese (II) sulfate(manganolangbeinite), K2Mn2(SO4) 3 ........ 6m 43Potassium manganese (II) trifluoride, KMnF3 6m 45Potassium nickel fluoride, KNiF,. .......... Potassium nickel (II) sulfate, K2Ni 2(SO4 ) 3 .... 7m 6m 4246Potassium niobium fluoride, K 2 NbF 7 ........ 8m 120Potassium nitrate (niter), KNO S ............ .3 58Potassium nitrite, KNO 2 .................. 9m 38Potassium nitroso chlororuthenate,K2RuCl 5 NO............................ 2m 29Potassium oxalate hydrate, K 2C 2 O 4 .H 2 O ..... 9m 39Potassium oxalate perhydrate, K 2C 2 O4 .H 2O 2 .. 9m 96Potassium perchlorate, KC1O 4 .............. 6 43Potassium perchromate, K 3 CrOt ............ 3m 44Potassium periodate, KIO4 ................. 7 41Potassium permanganate, KMnO 4 ........... 7 42Potassium perrhenate, KReO 4 ............. 8 41Potassium phosphomolybdate tetrahydrate,K 2P04(Mo0 3 ) 12 .4H 20 .................... 8 43Potassium selenate, K-jSeC^ ............... 9m 41Potassium sodium aluminum fluoride(elpasolite), K 5NaAlF. .................. Potassium sodium sulfate, KNaSO4 ......... 9m 6m 4350Potassium sodium sulfate, K, 67Na 1 . 33SO 4 .... 6m 48Potassium sodium sulfate (aphthitalite),K 3Na(S04 ) 2 ............................ 6m 52Potassium sulfate, K 2S 2 O 7 ................. 9m 99Potassium sulfate (arcanite), K2 SO 4 ......... 3 62Potassium thiocyanate, KCNS. ............. 8 44Potassium vanadium oxide, KV 3O 8 ......... Potassium zinc decavanadate 16 hydrate,8m 56K2 Zn 2 V ie028 - 16H 20 ..................... .3m 45Potassium zinc fluoride, KZnP, ............ 5 51Potassium zinc sulfate hexahydrate,K,Zn(SOJ,-6H,0....................... Potassium zinc sulfate, K2 Zn 2(SO4) 3 ........ 7m 6m 4354Praseodymium antimony, PrSb.............. 4m 43Praseodymium arsenate, PrAsO 4 ............ 4m 32Praseodymium arsenide, PrAs.............. 4m 67Praseodymium chloride, PrCl 3 ............. 1m 39Praseodymium fiuoride, PrF 3 ............... 5 52Praseodymium oxychloride, PrOCl .......... 9 47Praseodymium sulfide, PrS ................ 4m 67Praseodymium vanadate, PrVO4 ........... 5m 40Praseodymium zinc, PrZn ................. 5m 72Reserpine, C 33H 40N 2O 9 .................... 8m 123Rhenium, Re............................. 2 13Rhodium, Rh............................. 3 9Rhodium vanadium 1:3, RhV 3 ............... 6m 56Rubidium aluminum sulfate dodecahydrate,RbAl(S04 V 12H 20 ...................... 6 44Rubidium amide, RbNH 2 ................... 5m 7.3Rubidium bromate, RbBrO 3 ................. 8 45Rubidium bromide, RbBr................... 7 43Rubidium bromotellurate, Rb 3TeBr6 ......... 8 46Rubidium cadmium sulfate, Rb0 Cd0(SO^, .... Rubidium cadmium trichloride, high form,7m 45RbCdCl 3 (tetragonal).................... 5m 43m—Monograph 25.A mineral name in ( ) indicates a synthetic sample.Vol. orsec. PageRubidium cadmium trichloride, low form,RbCdCl a (orthorhombic) ................. 5m 41Rubidium calcium chloride, RbCaCl,. ....... 7m 47Rubidium calcium fluoride, RbCaP 3 ......... 8m 57Rubidium calcium sulfate, Rb0Ca,(SOJ,..... Rubidium chlorate, RbClO s ................ 7m 8 4847Rubidium chloride, RbCl .................. 4 41Rubidium chloroplatinate, Rb2PtCl 6 ......... 5 53Rubidium chlorostannate, Rb2SnCl 6 ......... 6 46Rubidium chlorotellurate, Rb 2TeCl 6 ......... 8 48Rubidium chromate, Rb 2CrO4 ............... :3m 46Rubidium chromium sulfate dodecahydrate,RbCr(S0 4 )2 .12H 20 ...................... 6 47Rubidium cobalt fluoride, RbCoP 3 .......... 8m 58Rubidium cobalt sulfate, Rb 2Co 2(SO 4 ) 3 ...... 8m 59Rubidium cobalt (II) trichloride, RbCoCl, .... 6m 57Rubidium copper sulfate hydrate,Rb 2Cu(SO 4 ) 2 -6H 2 O ...................... 8m 61Rubidium fluoplatinate, Rb2PtF6 ............ 6 48Rubidium fluoride, RbP ................... 8m 63Rubidum fluosilicate, Rb2SiP6 ............. 6 49Rubidium iodide, Rbl ..................... 4 43Rubidium iron sulfate hydrate,Rb 2Fe(SO 4 )2 *6H 2O ...................... 8m 64Rubidium magnesium chromium oxide,Rb2Mg2(CrO 4 X ......................... 8m 66Rubidium magnesium chromium oxide hydrate,Rb2Mg(CrO 4 )2 -6H 2O ..................... 8m 68Rubidium magnesium sulfate, Rb,Mg,(SO4), .. 7m 50Rubidium magnesium sulfate hydrate,Rb2Mg(SO 4 ) 2 '6H 2 O ..................... 8m 70Rubidium manganese sulfate, Rb 2Mn,(SO 4), .. 7m 52Rubidium manganese(II) trifluoride, RbMnF,. . 5m 44Rubidium nickel sulfate, Rb 2Ni 2(SO4) 3 ...... 8m 72Rubidium nickel sulfate hydrate,Rb2Ni(SO4V6H 2O ..................... 8m 74Rubidium nickel (II) trichloride, RbNiCl 3 .... 6m 58Rubidium nitrate, RbNO, (trigonal).......... 5m 45Rubidium oxalate perhydrate, Rb 2C 2 O4.H 2 O 2 .. 9m 102Rubidium perchlorate, RbClO 4 .............. 2m 30Rubidium periodate, RbIO4 ................. 2m 31Rubidium potassium chloride, Rb 0 . 5 K 0, 5 C1 .. 8m 76Rubidium selenate, Rb 2SeO4 ............... 9m 44Rubidium strontium chloride. RbSrCl, ....... 7m 54Rubidium sulfate, Rb2 SO 4 .................. 8 48Rubidium zinc fluoride, RbZnF,............ 7m 57Rubidium zinc sulfate hexahydrate,Rb,Zn(SO.)^6H,O...................... Ruthenium, Ru........................... 7m 4 555Ruthenium titanium, RuTi ................. 6m 86Samarium arsenate, SmAsO 4 ................ 4m 33Samarium arsenide, SmAs.................. 4m 68Samarium chloride, SmCl 3 .................. 1m 40Samarium fluoride, SmF s ................... 1m 41Samarium gallium oxide, Sm^Ga,(GaOJ,...... 1m 42Samarium oxide, Sm 2O s (cubic) ............ 4m 34Samarium oxychloride, SmOCl .............. 1m 43Samarium tin oxide, Sm 2Sn 2O 7 .............. 8m 77Samarium vanadate, SmVO4 ................ 5m 47Scandium arsenate, ScAsO4 ................ 4m 35Scandium arsenide, Sc.As .................. 4m 68Scandium oxide, Sc 2Os .................... 3 27Scandium phosphate, ScPO 4 ................ 8 50Scandium silicate (thortveitite), Sc 7Si 2O7 .... 7m 58Selenium, Se............................. 5 54Selenium oxide (selenolite), SeO-, (revised). 7m 60121

CUMULATIVE INDEX—ContinuedSilicon, Si ..............................Silicon dioxide, alpha or low quartz, SiO 2(hexagonal) ............................Silicon dioxide (alpha or low cristobalite),SiO 2 (tetragonal) (revised) ...............Silicon dioxide (beta or high cristobalite),SiO2 (cubic) ...........................Silver, Ag ...............................Silver, Ag (reference standard) ............Silver antimony sulfide, AgSbS2 (cubic) ......Silver antimony sulfide (miargyrite),,AgSbS2 (mono clinic) .....................Silver antimony sulfide (pyrargyrite), Ag3SbS3(trigonal) ..............................Silver antimony telluride, AgSbTe2 ..........Silver arsenate, Ag, AsO 4 ..................Silver arsenic sulfide, xanthoconite, Ag 3AsS 3Silver bromate, AgBrO, ....................Silver bromide (bromyrite), AgBr ............Silver carbonate, Ag 2CO s ..................Silver chlorate, AgClO 3 ...................Silver chloride, (cerargyrite), AgCl .........Silver cyanide , AgCn .....................Silver dysprosium, AgDy ..................Silver erbium, AgEr ........... ............Silver gadolinium, AgGd ...................Silver holmium, AgHo .....................Silver iodide (iodyrite), Agl (hexagonal) .....Silver iodide, gamma, Agl (cubic) ..........Silver molybdate, Ag 2MoO 4 .................Silver neodymium, AgNd ...................Silver nitrate, AgNO 3 .....................Silver nitrite, AgNO 2 ......................Silver oxalate, Ag 2C 2 O4 ...................Silver oxide, Ag2O ........................Silver(II) oxynitrate, Ag TO.NO s .............Silver periodate, AgIO4 ....................Silver permanganate, AgMnO 4 ..............Silver perrhenate, AgReO4 .................Silver phosphate, Ag,PO4 ..................Silver potassium cyanide, AgK(CN)± . ......Silver samarium. AgSm ....................Silver selenate, Ag2SeO 4 ..................Silver sodium chloride, Ag 0 . 5 Na0. 5 Cl .......Silver subfluoride, Ag 7F ...................Silver sulfate, Ag2 SO 4 ....................Silver sulfide (argentite), Ag,S .............Silver terbium, AgTb ......................Silver thulium, AgTm .....................Silver yttrium, AgY .......................Sodium, Na ..............................Sodium acid fluoride, NaHF2 ...............Sodium aluminum chloride silicate, sodalite,Sodium azide, alpha, NaN 3 , at— 90 to— 100°Sodium azide, beta, NaN 3 ...............Sodium borate, Na,B.O, t . ................Sodium borohydride, NaBH4 ..............Sodium bromate, NaBrO a .................Sodium bromide, NaBr ...................Sodium calcium aluminum fluoride hydrate,thomsenolite, NaCaAlF 6 -H 2O ..........m—Monograph 25.A mineral name in ( ) indicates a synthetic sample.Vol. orsec.10118m5m5m5m3m58m541m149m5m5m6m5m8915m559m1m497m858m5m2m8m5m7105m5m5m9m57m8m8m7m9538mPage62448422324849514756126574644444446666787685148457159604745614915553627873327953465174747510563158129130160516547132Sodium calcium beryllium aluminum fluorosilicate,meliphanite, (Na0 . 63Cau37)Be(Al0-13Slo .7) (0 6 25 F 0 75 ) .....................Sodium calcium beryllium fluorosilicate,leucophanite, NaCaBeFSi 2O 6 ............Sodium calcium carbonate hydrate, pirssonite,Na2Ca (C0 3 )2 .2H 20 .....................Sodium calcium sulfate (glauberlte),Na,Ca(S0 4 ) 2 ...........................Sodium carbonate monohydrate (thermonatrite),Na2CO a .H 20 ...........................Sodium chlorate, NaClO s ..................Sodium chloride (halite), Nad .............Sodium chromium oxide, Na 2CrO4 ...........Sodium chromium oxide hydrate,NaaCrO 4 .4H 3O .........................Sodium cobalt (II) sulfate tetrahydrate,Na2Co(S04 )2 .4H20 ......................Sodium cyanate, NaCNO ...................Sodium cyanide, NaCN (cubic) .............Sodium cyanide, NaCN (orthorhombic) at 6 ° CSodium dichromate dihydrate, Na,Cr,O,-2H,OSodium fluoride (villiaumite), NaF ..........Sodium hexametaphosphate hexahydrate,Sodium hydrogen silicate tetrahydrate,Na,H,SiO,-4H, O .......................Sodium hydrogen sulfate hydrate,NaHSO 4.H aO ...........................Sodium hydroxide, NaOH at 300 ° C .........Sodium iodate, NaIO s .....................Sodium iodide, Nal .......................Sodium iron fluoride, Na 3FeF 6 ............Sodium lanthanum fluosilicate,(Na.La.) (SiOAF, ......................Sodium magnesium aluminum boron hydroxysilicate, dravite, NaMg3 Al 6B 5Si 6O 27(OH)4 . .Sodium magnesium sulfate tetrahydrate,bloedite, Na2Mg(SO4 ) 2 -4H 2O ..............Sodium manganese (II) trifluoride, NaMnF3 . . .Sodium mercury (II) trichloride dihydrate,NaHgCl 3 .2H2O .........................Sodium molybdate, Na2MoO4 ................Sodium molybdenum oxide, Na 2 Mo 2 O 7 .......Sodium neodymium fluosilicate,(Na,Nd.) (Si0 4),F, ......................Sodium nickel (II) sulfate tetrahydrate,.NaaNi(SO4 )a r4H 2O .......................Sodium nitrate (soda-niter), NaNO s ..........Sodium nitrite, NaNO, .....................Sodium orthotungstate(IV) dihydrate,Sodium oxalate, Na2 C 2O4 ..................Sodium perchlorate, NaClO4 (orthorhombic). . .Sodium periodate, NaIO 4 ...................Sodium praseodymium fluosilicate,(Na, Pr.) (Si04 ) ftF2 ......................Sodium selenate , Na 2SeO4 .................Sodium silicate, alpha (III), NajSiaOs .....Sodium sulfate (thenardite), Na2SO4 .........Sodium sulfite, Na2SO 5 ....................Sodium te tram etaphosp hate tetrahydrate,alpha, Na4P4O l2-4H 2O (monoclinic) ........Sodium tetrametaphosphate tetrahydrate, beta,Na4P40 12.4H2O (triclinic) ................Sodium tin fluoride, NaSn,F,. ..............122Vol. orsec.8m8m9m6m8329m9m6m2m117m15m7m9m4m749m7m3m6m6m6m1m9m7m6m642m6m777m9m8m23102m7mPage13513810659545141485061;337879626354163526947315464:47636566.461106668506233704948685514159605235166

CUMULATIVE INDEX—ContinuedSodium trimetaphosphate, Na,P3O, ..........Sodium trimetaphosphate monohydrate,NaaP 1Ot-HaO ...........................Sodium tungstate, Na2 WO4 .................Sodium zinc sulfate tetrahydrate,Na>Zn(SO4)2 -4H 20 ......................Sodium zinc trifluoride, NaZnF 3 ............Sodium zirconium fluoride, Na7Zr 6F 31 .......Strontium arsenate, Srs(AsO4 )2 ..............Strontium azide, Sr(N 3 ) 2 ...................Strontium boron oxide, SrB^ ..............Strontium boron oxide, SrB4O 7 ..............Strontium bromide hexahydrate, SrBr2 -6H3O . . .Strontium carbonate (strontianite), SrCO s ....Strontium chloride, SrCl2 ..................Strontium chloride hexahy drate, SrCl a -6H 2O . .Strontium fluoride, SrP 2 ...................Strontium formate, Sr (CHO 2 ) 2 ..............Strontium formate dihydrate, Sr(CHO 2 )2 -2H 2O(orthorhombic) .........................Strontium indium hydroxide, Sr3In2(OH) 12 .....Strontium iodide hexahy drate, SrI 2 .6H 2 O .....Strontium molybdate, SrMoO4 ...............Strontium nitrate, Sr(NO,)2 .................Strontium oxide, SrO ......................Strontium peroxide, SrO 2 ...................Strontium scandium oxide hexahydrate,Sr3Sc2O6 .6H2O ..........................Strontium sulfate (celestite), SrSO 4 .........Strontium sulfide, SrS .....................Strontium telluride, SrTe ..................Strontium tin oxide, SrSno 3 ...............Strontium titanate, SrTiO s .................Strontium tungstate, Sr\VO 4 ................Strontium zirconate, SrZrO 3 ................Sulfamic acid, NH 3 SO S ....................Sulfur, S (orthorhombic) ...................Tantalum, Ta ............................d-Tartaric acid, C 4 H 6O,s ...................Tantalum silicide, TaSi, ..................Tellurium, Te ............................Tellurium(IV) oxide (paratellurite), TeO5(tetragonal)............................Tellurium(IV) oxide, paratellurite, TeO2(tetragonal)............................Tellurium(IV) oxide, tellurite, TeO 2 (orthorhombic)..............................Terbium arsenate, TbAsO4 .................Terbium arsenide, TbAs ...................Terbium nitride, TbN .....................Terbium phosphide, TbP ..................Terbium selenide, TbSe ...................Terbium sulfide, TbS .....................Terbium telluride, TbTe ...................Terbium vanadate, TbVO4 .................Thallium aluminum sulfate dodecahydrate,T1A1(SO4V 12H 20 .......................Thallium(I) arsenate, Tl»AsO4 ..............Thallium azide, TlN 3 .....................Thallium(I) bromate, TlBrO 3 ...............Thallium bromide, TIBr ...................Thallium cadmium sulfate, Tl 2Cd 2(SO 4) 3 ....Thallium(I) chlorate, T1C1O 3 ...............m—Monograph 25.A mineral name in ( ) indicates a synthetic sample.Vol. orsec. Page3m 493m1m6m6m8m2m8m3m4m43445886m871566m274m8m3797917m811093m5m4m5m5m5m5m5m62m8m878m8504772741443614653366056405867555676585080685278615269804453515454291685926565557547570767677775653378260578361Vol. orsec. PageThallium(I) chloride, T1C1 ................. 4 51Thallium chloroplatinate, Tl 2 PtCls .......... 5 70Thallium chlorostannate, Tl2SnCl 6 .......... 6 54Thallium chromate, Tl 2 CrO4 ................ 3m 54Thallium chromium sulfate do decahy drate,TlCr(SO 4 )2 .12H 20....................... 6 55Thallium cobalt sulfate, Tl 2Co 2(SO 4 ) 3 ....... 8m 85Thallium cobalt sulfate hexahydrate,Tl 5 Co(SQ4 ) 7 -6H 2O...................... 7m 70Thallium copper sulfate hexahydrate,T1 9 Cu(SQJ,-6H,O .....................Thallium fluosilicate, Tl 2SiF 6 ..............7m67256Thallium gallium sulfate dodecahydrate,TlGa(S0 4 ) 3 .12H 20 ...................... 6 57Thallium(I) iodate, TlIO a ................. 8 62Thallium(I) iodide, Til (orthorhombic) ....... 4 53Thallium iron sulfate hydrate,Tl 2Fe(SO 4V6H 2O ......................Thallium magnesium chromium oxide,8m 87Tl 2Mg 2(Cr0 4 ) 3 ......................... 8m 89Thallium magnesium sulfate hexahydrate,Tl 2Mg(S04 )a .6H aO....................... 7m 74Thallium manganese sulfate, Tl 2Mn,(SO 4 ) s ... 7m 76Thallium nickel sulfate hexahydrate,Tl aNi(SO4 ) 2 .6H aO ....................... 7m 78Thallium(I) nitrate, T1NO, ................. 6 58Thallium(III) oxide, T1 2O 3 ................. 2 28Thallium(I) perchlorate, T1C1O 4 ............ 2m 38Thallium(I) phosphate, T1 3 PO 4 ............ 7 58Thallium(III) phosphate, T1PO 4 ............. 7 59Thallium(I) sulfate, T1 2 SO4 ................ 6 59Thallium(I) thiocyanate, T1CNS ............ 8 63Thallium(I) tungstate, T1 2WO 4 .............. 1m 48Thallium zinc sulfate hexahydrate,Tl.Zn (SO 4) 9.6H,0 ......................Thorium arsenide, ThAs...................7m4m8070Thorium oxide (thorianite), ThOa ........... 1 57Thulium arsenate, TmAsO4 ................ 3m 56Thulium arsenide, TmAs .................. 4m 71Thulium nitride, TmN ..................... 4m 71Thulium sesquioxide, Tm 2O 3 ............... 9 58Thulium telluride, TmTe .................. 4m 72Thulium vanadate, TmVO4 ................. 5m 57Tin, alpha, Sn (cubic)..................... 2 12Tin, beta, Sn (tetragonal).................. 1 24Tin arsenide, SnAs ........................ 4m 37Tin(II) fluoride, SnF2 ..................... 3m 51Tin(IV) iodide, SnI4 .......................Tin(U) oxide, SnO ........................547128Tin(IV) oxide (cassiterite), SnO 2 ........... 1 54Tin sulfide (berndtite), beta, SnS2 .......... 9m 57Tin(II) telluride, SnTe .................... 7 61Titanium, Ti............................. 3 1Titanium dioxide, brookite, TiO2 (orthorhombic).............................. 3m 57Titanium oxide (anatase), TiO 9 (revised) .... 7m 82Titanium oxide (rutile), TiO 7 (revised) ......Titanium(IH) oxide, TiO,. sls ...............7m98359Titanium silicide, Ti s Si 3 .................. 8 64Titanium sulfide, TiS2 .................... 4m 72Titanium sulfide, Ti 2S .................... 8m 149Trimethylammonium chloride, (CH 3 ) 3NHC1 ... 9m 1132,4,6—Trinitrophenetole, C 2H 5 OC ftH,(NO 5 )*. . .Tungsten, \V .............................8m115228Tungsten, W (reference standard) .......... 8m 2123

CUMULATIVE INDEX—ContinuedTungsten sulfide (tungstenite), WS2 . . .Uranium dioxide (uraninite), UO2 .....Uranium oxide, UO .................Uranium selenide, USe ..............Uranium telluride, UTe ..............Urea, CO(NH 2) 7 ....................Uric acid, C 5 H4N4O 3 ...............Vanadium, V ......................Vanadium(V) oxide, V,O, ............Ytterbium arsenate, YbAsO 4 .........Ytterbium arsenide, YbAs ...........Ytterbium gallium oxide, Yb,Ga 3(GaO 4),Ytterbium nitride, YbN ..............Ytterbium oxide, Yb2O 3 ..............Ytterbium selenide, YbSe............Ytterbium telluride, YbTe ...........Ytterbium(III) vanadate, YbVO 4 .......Yttrium arsenate, YAsO4 ............Yttrium arsenide, YAs ..............Yttrium gallium oxide, Y,Ga,(GaO 4), ..Yttrium oxide, Y 2O3 .................Yttrium oxychloride, YOGI...........Yttrium phosphate (xenotime), YPO4 . .Yttrium sulfide, YS .................Yttrium telluride, YTe ..............Yttrium vanadate, YVO 4 .............Zinc, Zn ...........................Zinc aluminate (gahnite), ZnAl 2 O 4Zinc antimony oxide, ZnSb2O4 ........Zinc borate, ZnB7O4 ................Vol. or,ec. Page8 65 Zinc carbonate, smithsonite, ZnCO, ........2 33 Zinc chromium oxide, ZnCr 2 O 4 .............5m 78 Zinc cyanide, Zn(CN) 2 ....................5m 78 Zinc fluoride, ZnF 2 ......................4m 73 Zinc fluosilicate hexahydrate, ZnSiF 6 *6H 2O ..7 61 Zinc germanate, Zn2 GeO4 ..................8m9m15458Zinc glutamate dihydrate, ZnC«H,N(V2H,,OZinc iodide, ZnI 2 .........................8 66 Zinc iron oxide (franklinite), ZnFe 2 O4 ......4m4m3873Zinc molybdate, Zn,Mo,O. I................Zinc orthosilicate (willemite), ZnaSiO 4 ......1m 49 Zinc oxide (zincite), ZnO .................4m 74 Zinc pyrosilicate hydrate, hemimorphite,6m 80 Zn4(OH)2 Si 20 7 .H 20......................5m 79 Zinc selenide, ZnSe......................5m 79 .Zinc sulfate (zinkosite), ZnSO4 ............5m 58 .Zinc sulfate heptahydrate (goslarite),2m 39 ZnS04 .7H 20 ...........................4m 74 Zinc sulfide (wurtzite), alpha ZnS (hexag-1m 50 onal) .................................3 28 Zinc sulfide (sphalerite), beta ZnS (cubic).. .1m 51 Zinc telluride, ZnTe......................8 67 Zinc tungstate (sanmartinite), ZnWO 4 .......5m 80 Zirconium, alpha, Zr......................4m 75 Zirconium dihydride, ZrH2 .................5m 59 Zirconium iodate, Zr(IO 3 )4 .................1 16 Zirconium nitride, ZrN ....................2 38 Zirconium oxide, ZrO .. .................. .4m 39 Zirconium phosphide, ZrP .................1 83 Zirconium silicate, zircon, ZrSiO 4 ......,..,Zirconium sulfate tetrahydrate, Zr(SO 4)2 -4H2OVol. orsec. Page8 699m 595 736 608 7010 567m 1709 609m 607m 1737 622 252378223m2m25m1m5m5m4m4762236471141658401160518081756866m—Monograph 25.A mineral name in ( ) indicates a synthetic sample.124

CUMULATIVE MINERAL INDEXAlabandite, MnS.......................Alum, KA1(S04 )2 .12H 20 .................Ammonia-niter, NH4NO a ................Anatase, TiO, (revised) ................Andradite, Ca,Fe2Si SO 12 ................Anglesite, PbSO4 ......................Anhydrite, CaSO4 ......................Aphthitalite, K3Na(SO4 )2 ................Aragonite, CaCO 3 .....................Argentite, Ag2S .......................Arcanite, K2SO4 .......................Arsenolite, As2O 3 .....................Aurostibite, AuSb2 ....................."Azurite, Cu 3(OH) 2(CO 3 ) 2 ................Barite, BaSO4 .........................Berlinite, A1PO4 ......................Berndtite, SnS2 .......................'Beryl, Be sAl 2(SiO 3) 6 ..................Bismite, (alpha) Bi 2O3 .................Bismoclite, BiOCl.....................Bismuthinite, Bi 2S3 (revised)............'Bloedite, Na^Mg(SO4)2 ..4H2O............Bohraite, A12O 3.H2O....................Bromellite, BeO .......................Bromyrite, AgBr.......................*Brookite, TiO2 .......................Brucite, Mg(OH)2 ......................Bunsenite, NiO .......................Calcite, CaCO 3 .......................Calomel, Hg2Cl2 .......................Carnallite, KMgCl 3 -6H 2O ..............Cassiterite, SnO 2 ......................Celestite, SrSO4 .......................Cerargyrite, AgCl .....................Cerianite, CeO 2 .......................Cerussite, PbCO, .....................Cervantite, Sb2O4 ......................Chalcocyanite, CuSO4 ..................Chloraluminite, A1C1 3 -6H 2O .............Chlorocalcite, KCaCl,. .................Chrysoberyl, BeAl 2O4 ..................Cinnabar, HgS ........................*Claudetite, As2O3 ....................Clausthalite, PbSe ....................Cordierite, Mg^A^SijO^ (orthorhombic) ..Cordierite, Mg^lJSigO^-(hexagonal).....Corundum, A1 2O 3 ......................Cotunnite, PbCl2 ......................Covellite, CuS ........................Cristobalite, (alpha or low) SiO 2 (revised)Cristobalite, (beta or high) SiO 2 .........*Cryolithionite, Li 3Na 3Al 2F 12 ...........Cryptohalite, (NH4 )2SiF6 ................Cuprite, Ci^O ........................*Diamond, C..........................*Diaspore, A1 2O 3 -H 2O ..................Diopside, CaMg(SiO 3 )2 ................."Dravite, NaMg3Al 6B3Si 6O27(OH)4 ........Elpasolite, K 2NaAlF 6 ..................*Enstatite, MgSiO 3 ....................Epsomite, MgSO 4 -7H 2O .................Eschynite, CeNbTiO6 ..................Eskolaite, C r 2O 3 .....................* Natural mineral,M-Monagraph 25.Vol. orsec77m9346m310317103109m93m45m6m3143m61218m12412103m77m943m51m1m9241019m52235m3m9m673m5Page11364822267655253516251183065357131754136.33836465730475172505461445656829336101793828293451348422352354117474332302422Vol. orsec.Ettringite, Al 2O 3 .6CaO.3SO 3 .31H 2O ........ 8Fairchildite, K 2Ca(CO 3) 2 ................. 8mJFluorapatite, Cas F(PO4) 3 ................. 3mFluorite, CaF2 .......................... 1Porsterite, Mg2SiO4 ...................... 1Franklinite , ZnFe 2 O4 .................... 9mFresnoite , Ba2TiSi 2 Os ................... 9mGalaxite, MnAl 2O4 ....................... 9Galena, PbS ............................ 2Gahnite, ZnAl 2O4 ........................ 2Geikielite, MgTiO 3 ...................... 5Gersdorffite, NiAsS ...................... 1mGlauberite, NaaCa(SO4) a .................. 6mGoslarite, ZnSO4 -7H 2O ................... 8Greenockite, CdS ........................ 4Halite, NaCl ............................ 2"Hemimorphite, Zn4(OH)2Si 2O7 -H 2O ......... 2Hieratite, K2SiF6 ........................ 5Huebnerite, Mn\VO4 ...................... 2mHumite, 3Mg2SiO4 -MgF2 ................... 1mlodyrite, Agl ............................ 8Jacobsite, MnFe 2O4 ...................... 9Langbeinite, K2Mg2(SO4)3 ................. 6m*Leucophanite, NaCaBeFSi2O 6 .......... 8mLitharge, PbO (red) ..................... 2Lithiphosphate, Li 3PO 4 .................. 4mlioellingite, FeAs2 ...................... 10Magnesite, MgCO 3 ....................... 7Magnetite, Fe 3O4 ........................ 5mMalachite, Cu2(OH)2 CO 3 .................. 10Manganolangbeinite, K2Mn2(SO4) 3 .......... 6mManganosite, MnO ....................... 5Marshite, Cul ........................... 4Mascagnite, (NH4 )2SO4 (revised) ........... 9Massicot, PbO (yellow) .................. 2Matlockite, PbFCl .......................1Melanterite, FeSO 4 -7H 2O ................. 8m*Meliphanite, Na.^Ca! 37BeAl. 13Si .. 7O 6 . 25 F 47s 8mMetacinnabar, HgS ....................... 4Miargyrite, AgSbS2 ....................... 5m*Millerite, NiS .......................... 1mMinium, Pb 3O4 .......................... 8Mitscherlichite, K 3CuCl4.2H 2 O ............ 9mMolybdenite, MoS, ....................... 5Molybdite, MoO s ......................... 3Montroydite, HgO (revised) ............... 9Mullite, 3Al 2O s.2Si02 .................... 3mNantokite, CuCl ......................... 4'Newberyite, MgHPO4 -3H 2O ............... 7mNiter, KNO S ............................ 3Nitrobarite, Ba(NO 3 )2 .................... 1Norbergite, Mg2SiO 4 -MgF 2 ................. 10Oldhamite, CaS ......................... 7Otavite, CdCO 3 ......................... 7Oxammite, (NH4 )2C2O 4 -H2O ................ 7*Paratellurite, TeO2 ..................... 10Paratellurite, TeO 2 ...................... 7Partridgeite, Mn 2O3 ...................... 9Periclase, MgO .........................1Perovskite , CaTiO 3 ..................... 9m*Phenacite, Be 2SiO 4 ..................... 8Picrochromite, MgCr2O 4 .................. 9Picromerite, K 2Mg(SO 4 )2-6H 2O ............. 8m'Pirssonite, Na 2Ca (CO 3 ) 2.2H2 O .......... 9mPortlandite, Ca(OH) 2 .....................1Powellite, CaMoO4 ...................... 6125Page348226983601435183843355971154162502430513640138302134283131434538832763813521493732344730393351395881391511555563737171134541065822

CUMULATIVE MINERAL INDEX—ContinuedPyrargyrite, Ag 3SbS 3 ......Pyrite, FeS2 ..............Pyrope, Mg,Al,(SiOA ......* Quartz, SiO2 (alpha or low)Rammelsbergite, NiAs 3 .....Retgersite, NiSO4 -6H 2 O ....Rhodochrosite, MnCO, .....Rutile, TiO 2 (revised)......Safflorite, CoFeAs 4 ........Sal-ammoniac, NH4C1 ......Sanmartinite, ZnWO 4 .......Scacchite, MnCl 2 ..........*Scheelite, CaWO4 . ........Selenolite, SeO, (revised) .. ,Sellaite, MgF 2 ............Senarmontite, Sb^........Skutterudite, CoAs 3 ........*Smithsonite, ZnCO 3 .......*Sodalite, Na.SUAljD^Cl, . .Soda-niter, NaNO 3 .........Sphalerite, ZnS ...........Spherocobaltite, CoCO 3 ....Spinel, MgAl2O 4 ...........Spinel, MgAl 2O4 (revised) . . .Stibnite, Sb 2S3 ............Stolzite, PbWO 4 (revised). . .Strontianite, SrCO, ........Vol. orsec. Page5m 51 Struvite, MgNH4PO 4 -6H 2O....,,..5 29 Sylvite, KCl ...................4m 24 *Tellurite, TeO 2 ...............3 24 Tellurobismuthite, Bi 2Tes .......10 42 7 36 Tenorite, CuO .................Teschemacherite, NH4HCO 3 ......7 32 Tschermigite. NH4A1(SO 4V12H,O7m 83 Thenardite, Na2SO4 .............10 28 Thermonatrite, NajCOj-HjO ......1 59 *Thomsenolite, NaCaAlP 6 .H 2O ...2m 40 Thorianite, ThO 3 ...............8m 43 Thortveitite, Sc7Si,O 7 ...........6 23 Tiemannite, HgSe ..............7m 60 * Topaz, Al 2Si04(F,OH) 2 .........4 33 Trevorite, NiFe2O4 .............3 31 Tungstenite, WS2 ...............10 21 Uraninite, UO 2 .................8 69 Uvarovite, CasCr2(SiO4 )s .........7m 158 *Valentinite, Sb2O 3 .............6 50 2 16 Villiaumite, NaF ...............Willemite, Zn ?SiO4 ..............10 24 Witherite, BaCO3 ...............2 35 Wulfenite, PbMoO4 ..............9m 25 Wurtzite, ZnS ..................5 6 *Xanthoconite, Ag 3AsS 3 ........5m 34 .Xenotime, YPO4 ...............3 56 Zincite, ZnO ..................Zinkosite, 2nSO4 ...............^Zircon, ZrSi04 ................Vol. orsec.3m193m196288m17m71m10821010172728m8274Page41655716495359541325758354446533176636254231412667256468* Natural mineral.m—Monograph 25.126

FORM HBS- -TtTU.S. DEPT. OF COMM.BIBLIOGRAPHIC DATA______SHEET_____4. TITLE AND SUBTITLE^PUBLICATION OR REPORT NO.NBS-MN 25-9Standard X-ray Diffraction Powder PatternsSection 9. ——— Data for 63 Substances7. AUTHOR(S) Howard E. Swanson, Howard F. McMurdie, Marlene C. Morr;loise H. Evans. B. Paretzkin, Johan H. deGroot & Simon J, Carmel9. PERFORMING ORGANIZATION NAME AND ADDRESSNATIONAL BUREAU OF STANDARDSDEPARTMENT OF COMMERCEWASHINGTON, D.C. 202343. Recipient s Accession No.S. Publication DateDecember. 1Q714. Perfooaia$ Or£aiu£ftti on Code^Performing Organization10. Project/Task/Work Unit No.313016211. Contract/Grant No.12. Sponsoring Organization Name and Address 13. Type of Report & PeriodCoveredFinal_________14. Sponsoring Agency Code15. SUPPLEMENTARY NOTES6. ABSTRACT (A 200-word or less factual summary of most significant information. If document includes a significantbibliography or literature survey, mention it here.)Standard x-ray diffraction patterns are presented for 63 substances. Forty of thesepatterns represent experimental data and 23 are calculated. The experimental x-raypowder diffraction patterns were obtained with an x-ray diffractometer. All d-valueswere assigned Miller indices determined by comparison with computed interplanarspacings consistent with space group extinctions. The densities and lattice constant;were calculated, and the refractive indices were measured whenever possible. Thecalculated x-ray powder diffraction patterns were computed from published crystalstructure data. Both peak height and integrated intensities were reported for thecalculated patterns.17. KEY WORDS (Alphabetical order, separated by semicolons)Crystal structure; integrated intensities; lattice constants; peak intensities; powdeipatterns; reference intensities; standard; x-ray diffraction18. AVAILABILITY STATEMENTEx] UNLIMITED.I I FOR OFFICIAL DISTRIBUTION. DO NOT RELEASETO NTIS.19. SECURITY CLASS(THIS REPORT)UNCLASSIFIED20. SECURITY CLASS(THIS PAGE)UNCLASSIFIED21. NO. OF PAGES12822. Price$1.25G6244-P71

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