Kohn-Sham band gaps and potentials of solids from the optimised effective potential method within the random phase approximation.
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Adiabatic-connection fluctuation-dissipation DFT for the structural properties of solids-The renormalized ALDA and electron gas kernels.Lattice energies of molecular solids from the random phase approximation with singles corrections.Accurate Kohn-Sham ionization potentials from scaled-opposite-spin second-order optimized effective potential methods.Self-consistent Kohn-Sham method based on the adiabatic-connection fluctuation-dissipation theorem and the exact-exchange kernel.How close are the Slater and Becke-Roussel potentials in solids?Importance of the Kinetic Energy Density for Band Gap Calculations in Solids with Density Functional Theory.Singles correlation energy contributions in solids.Fock-exchange for periodic structures in the real-space formalism and the KLI approximation.Hubbard-Ucorrected Hamiltonians for non-self-consistent random-phase approximation total-energy calculations: A study of ZnS,TiO2, and NiOStatic correlation and electron localization in molecular dimers from the self-consistent RPA andGWapproximation
P2860
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P2860
Kohn-Sham band gaps and potentials of solids from the optimised effective potential method within the random phase approximation.
description
2014 nî lūn-bûn
@nan
2014 թուականի Փետրուարին հրատարակուած գիտական յօդուած
@hyw
2014 թվականի փետրվարին հրատարակված գիտական հոդված
@hy
2014年の論文
@ja
2014年論文
@yue
2014年論文
@zh-hant
2014年論文
@zh-hk
2014年論文
@zh-mo
2014年論文
@zh-tw
2014年论文
@wuu
name
Kohn-Sham band gaps and potent ...... he random phase approximation.
@ast
Kohn-Sham band gaps and potent ...... he random phase approximation.
@en
type
label
Kohn-Sham band gaps and potent ...... he random phase approximation.
@ast
Kohn-Sham band gaps and potent ...... he random phase approximation.
@en
prefLabel
Kohn-Sham band gaps and potent ...... he random phase approximation.
@ast
Kohn-Sham band gaps and potent ...... he random phase approximation.
@en
P2860
P356
P1476
Kohn-Sham band gaps and potent ...... the random phase approximation
@en
P2093
Jiří Klimeš
P2860
P304
P356
10.1063/1.4863502
P407
P577
2014-02-01T00:00:00Z