Ensemble TDDFT generalizes TDDFT and EDFT by ensemble-extending the Gross-Kohn equation and XC kernel and applying EDFT to time-dependent problems, illustrated on the 2-site Hubbard model.
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CP-DFT on periodic solids gives the exchange-correlation hole directly, exposing d-orbital correlations in CsV3Sb5 that standard DFT misses and that enhance charge-density-wave signals.
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Ensemble Time-Dependent Density Functional Theory
Ensemble TDDFT generalizes TDDFT and EDFT by ensemble-extending the Gross-Kohn equation and XC kernel and applying EDFT to time-dependent problems, illustrated on the 2-site Hubbard model.
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Conditional probability density functional theory for solids
CP-DFT on periodic solids gives the exchange-correlation hole directly, exposing d-orbital correlations in CsV3Sb5 that standard DFT misses and that enhance charge-density-wave signals.