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Volumn 116, Issue 19, 2002, Pages 8276-8291

Exchange-only optimized effective potential for molecules from resolution-of-the-identity techniques: Comparison with the local density approximation, with and without asymptotic correction

(3) Hamel, Sébastien a,b Casida, Mark E c Salahub, Dennis R a,b,d

a UNIVERSITÉ DE MONTRÉAL (Canada)

b Centre de Recherche en Calcul Applique (Canada)

c UNIVERSITÉ JOSEPH FOURIER (France)

d NATIONAL RESEARCH COUNCIL CANADA (Canada)

Author keywords

[No Author keywords available]

Indexed keywords

ALGORITHMS; APPROXIMATION THEORY; ASYMPTOTIC STABILITY; CHARGE CARRIERS; DECOMPOSITION; ELECTRONS; ENERGY GAP; ETHYLENE; GREEN'S FUNCTION; GROUND STATE; HAMILTONIANS; INTEGRAL EQUATIONS; IONIZATION; OPTIMIZATION; PERTURBATION TECHNIQUES; PROBABILITY DENSITY FUNCTION;

LOCAL DENSITY APPROXIMATIONS (LDA); OPTIMIZED EFFECTIVE POTENTIALS (OEP);

MOLECULAR PHYSICS;

EID: 0037088373 PISSN: 00219606 EISSN: None Source Type: Journal
DOI: 10.1063/1.1467900 Document Type: Article

Times cited : (50)

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