Discontinuities of the exchange-correlation kernel and charge-transfer excitations in time-dependent density-functional theory

Physical Review A - Atomic, Molecular, and Optical Physics

Volumn 85, Issue 2, 2012, Pages

  Hellgren, Maria ^a   Gross, E K U ^a  

^a MAX PLANCK INSTITUTE OF MICROSTRUCTURE PHYSICS   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

CHARGE-TRANSFER EXCITATIONS; DONOR ORBITALS; DONOR-ACCEPTOR SYSTEM; EIGEN-VALUE; EXCHANGE-CORRELATION KERNEL; EXCHANGE-CORRELATIONS; FIRST ORDER; FREQUENCY-DEPENDENT; PARTICLE NUMBERS; TIME DEPENDENT DENSITY FUNCTIONAL THEORY;

CHARGE TRANSFER; EIGENVALUES AND EIGENFUNCTIONS;

TIME VARYING SYSTEMS;

EID: 84857563678     PISSN: 10502947     EISSN: 10941622     Source Type: Journal    
DOI: 10.1103/PhysRevA.85.022514     Document Type: Article

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