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.
Title resolution pending
2 Pith papers cite this work. Polarity classification is still indexing.
2
Pith papers citing it
citation-role summary
background 1
citation-polarity summary
fields
physics.chem-ph 2verdicts
UNVERDICTED 2roles
background 1polarities
background 1representative citing papers
The paper establishes an exact N-centered ensemble DFT formalism unifying neutral and charged excitations and introduces three practical strategies: weight-dependent scaling of ground-state functionals, quasi-degenerate ensemble perturbation theory, and quantum bath embedding for excited states.
citing papers explorer
-
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.
-
Ensemble density functional theory of excited states: Exact N-centered formalism and practical opportunities
The paper establishes an exact N-centered ensemble DFT formalism unifying neutral and charged excitations and introduces three practical strategies: weight-dependent scaling of ground-state functionals, quasi-degenerate ensemble perturbation theory, and quantum bath embedding for excited states.