Draft Final Program · 245th ACS National Meeting, New Orleans, LA ...
Draft Final Program · 245th ACS National Meeting, New Orleans, LA ...
Draft Final Program · 245th ACS National Meeting, New Orleans, LA ...
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<strong>Draft</strong> <strong>Final</strong> <strong>Program</strong> <strong>·</strong> <strong>245th</strong> <strong>ACS</strong> <strong>National</strong> <strong>Meeting</strong>, <strong>New</strong> <strong>Orleans</strong>, <strong>LA</strong> <strong>·</strong> Ca... http://abstracts.acs.org/chem/245nm/mmadmin/index.php?content_name=...<br />
Theory and Simulation in Energy and Fuel Production and Utilization<br />
Q. Ge, Organizer<br />
P. Hu, Organizer, Presiding<br />
8:00 356. How do metal clusters split water? Towards a theoretical understanding of co-catalysts for water oxidation. H.<br />
Oberhofer, K. Reuter<br />
8:40 357. First principles analysis of selectivity trends in heterogeneous biomass conversion. B. Liu, R. Rankin, J.<br />
Greeley<br />
9:10 358. Hydrogen storage in porous materials and nanoalloys as catalysts for fuel cell application by using multiscale<br />
simulation and experimental methods. D. Cheng, D. Cao, W. Wang<br />
9:40 359. DFT studies of ethonal decomposition on Rh catalyst with and without water. J. Zhang, X. Cao, P. Hu, Z.<br />
Zhong<br />
10:00 Intermission.<br />
10:10 360. Predicting desulfurization and combustion chemistry. W. H. Green, C. A. Class, S. S. Merchant, A. K.<br />
Vasiliou<br />
10:40 361. Complexity in the transformation of biomass derived compounds: A theoretical approach. N. Lopez<br />
11:10 362. First-principles-based kinetic Monte Carlo simulations of methanol synthesis on copper surfaces. D. Mei<br />
11:40 363. DFT study of Mo2C and M-MoS2 surface morphology and catalysis. T. Wang, Y. Chen, H. Jiao<br />
Morial Convention Center<br />
238<br />
Bioenergy and Biofuels<br />
Cosponsored by CEI<br />
D. Robichaud, M. Nimlos, L. Moens, Organizers<br />
C. Mukarakate, F. Zhao, Organizers, Presiding<br />
8:10 Introductory Remarks.<br />
8:15 364. Reassessment of global bioenergy potential in 2050. S. Y. Searle, C. J. Malins<br />
Section E<br />
8:35 365. Renewable fuels' heat of vaporization values measured with vacuum thermogravimetric analysis method. G.<br />
Zhou, S. H. Roby, T. Wei, N. Yee<br />
8:55 366. Direct conversion of waste cooking oil into biodiesel via direct sonication. G. E. Grant, V. Gude<br />
9:15 367. Pathways in the low-temperature oxidation chemistry of alcohols. O. Welz, J. Zádor, J. D. Savee, A. J. Eskola,<br />
L. Sheps, D. L. Osborn, C. A. Taatjes<br />
9:35 368. Low temperature properties of renewable terpenoid fuel blends. B. G. Harvey, H. A. Meylemans, L. C.<br />
Baldwin<br />
9:55 Intermission.<br />
10:10 369. Enthalpy biofuels unified performance. N. M. Irving<br />
10:30 370. Organocatalytic upgrading of biorefining building blocks and subsequent transformation to liquid fuels. D.<br />
Liu, E. Y. Chen<br />
10:50 371. Hydrodeoxygenation of palmitic acid using molybdenum carbide catalysts in high-temperature water. A. R.<br />
Franck, P. E. Savage, L. T. Thompson<br />
11:10 372. Experimental, modeling, and optimization of pilot plant scale biodiesel production using heteropolyacid<br />
28 of 61 1/27/2013 5:06 PM
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