time-dependent DFT

GPTKB entity

Statements (24)
Predicate Object
gptkbp:instanceOf quantum mechanical method
gptkbp:abbreviation gptkb:TDDFT
gptkbp:appliesTo many-electron systems
gptkbp:basedOn gptkb:density_functional_theory
gptkbp:developedBy gptkb:Elliott_H._Lieb
gptkb:E.K.U._Gross
gptkb:Erich_Runge
gptkbp:firstPublished 1984
gptkbp:governs gptkb:time-dependent_Kohn-Sham_equations
https://www.w3.org/2000/01/rdf-schema#label time-dependent DFT
gptkbp:relatedTo gptkb:photoelectron_spectroscopy
linear response theory
quantum dynamics
optical absorption spectra
electronic excitations
non-adiabatic processes
gptkbp:usedFor studying excited states
simulating time-dependent phenomena
gptkbp:usedIn computational chemistry
condensed matter physics
materials science
gptkbp:bfsParent gptkb:Quantum_ESPRESSO
gptkb:VASP
gptkbp:bfsLayer 6