Electron affinities and ionisation potentials for atoms via "benchmark" tdDFT calculations with and without exchange kernels

Journal of Chemical Physics

Volumn 138, Issue 1, 2013, Pages

  Gould, Tim ^a   Dobson, John F ^a  

^a GRIFFITH UNIVERSITY   (Australia)

Author keywords

[No Author keywords available]

Indexed keywords

ADIABATIC CONNECTION FLUCTUATION DISSIPATIONS; CORRELATION ENERGY; ENERGY DIFFERENCES; EXACT EXCHANGE; GROUND-STATE ENERGIES; MEAN ABSOLUTE ERROR; MODEL EXCHANGE; RANDOM-PHASE APPROXIMATION; REAL-SPACE;

DENSITY FUNCTIONAL THEORY; ERRORS; IODINE; IONIZATION;

ATOMS;

EID: 84872057599     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4773066     Document Type: Article

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