IV) Materials calculations with dynamical mean field theory (DMFT)
IV) Materials calculations with dynamical mean field theory (DMFT) IV) Materials calculations with dynamical mean field theory (DMFT)
from static.ifp.tuwien.ac.at
More from this publisher
10.07.2015
Views
Experimental motivation — (Cr x V 1−x ) 2 O 3McWhan et al.’73Cr-doping x ≡ volume changeMcWhan, Remeika’70
Experimental motivation — (Cr x V 1−x ) 2 O 3←→McWhan et al.’73Cr-doping x ≡ volume changeMcWhan, Remeika’70←→ Mott-Hubbard transitionU: local Coulomb interactionW : bandwidth
- Page 1 and 2: IV) Materials calculations withdyna
- Page 3 and 4: Ab-initio electronic Hamiltonian(no
- Page 5 and 6: Ab-initio electronic Hamiltonian(no
- Page 8 and 9: Ab-initio electronic Hamiltonian(no
- Page 10 and 11: LDA+UAnisimov et al.’91LDA+U: Sol
- Page 12 and 13: LDA+DMFTSolveĤ by dynamical mean f
- Page 14 and 15: ¡ ¡ ¡ ¡ ¡ ¡ ¡ ¡¡ ¡ ¡ ¡
- Page 16: ¡ ¡ ¡ ¡ ¡ ¡ ¡ ¡¡ ¡ ¡ ¡
- Page 19 and 20: ¡ ¡ ¡ ¡ ¡ ¡ ¡ ¡¡ ¡ ¡ ¡
- Page 21 and 22: ¡ ¡ ¡ ¡ ¡ ¡ ¡ ¡¡ ¡ ¡ ¡
- Page 23 and 24: LDA+DMFT — overviewMetzner, Vollh
- Page 25 and 26: Dynamical mean field theory (DMFT)d
- Page 27 and 28: Dynamical mean field theory (DMFT)d
- Page 29 and 30: Dynamical mean field theory (DMFT)d
- Page 31 and 32: First something easier......Weiss m
- Page 33 and 34: First something easier......Weiss m
- Page 35 and 36: First something easier......Weiss m
- Page 37 and 38: DMFT self-consistency cycleG(ω) =
- Page 39 and 40: DMFT self-consistency cycleG(ω) =
- Page 41: Experimental motivation — (Cr x V
- Page 45 and 46: One-band Hubbard modelĤ = − t∗
- Page 47 and 48: Numerical results - spectrumSpectru
- Page 49 and 50: Numerical results - spectrumSpectru
- Page 51 and 52: Numerical results - spectrumSpectru
- Page 53 and 54: Numerical results - spectrumSpectru
- Page 55 and 56: Numerical results - spectrumSpectru
- Page 57 and 58: Numerical results - spectrumSpectru
- Page 59 and 60: Numerical results - spectrumSpectru
- Page 61 and 62: Numerical results - spectrumSpectru
- Page 63 and 64: Phase diagramDMFT(NRG) Bulla, Costi
- Page 65 and 66: LDA+DMFT for (V 0.962 Cr 0.038 ) 2
Experimental motivation — (Cr x V 1−x ) 2 O 3McWhan et al.’73Cr-doping x ≡ volume changeMcWhan, Remeika’70
Change language