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International Journal of Quantum Chemistry

Volumn 85, Issue 4-5, 2001, Pages 421-431

Generalized spin density functional theory for noncollinear molecular magnetism II - Influence of gradient correction and self-interaction correction

(4) Yamanaka, S a Yamaki, D a Kiribayashi, S a Yamaguchi, K a

a OSAKA UNIVERSITY (Japan)

Author keywords

Generalized spin density functional theory; Noncollinear molecular magnetism; Self interaction correction

Indexed keywords

APPROXIMATION THEORY; CALCULATIONS; MAGNETISM; MOLECULAR STRUCTURE; PROBABILITY DENSITY FUNCTION; SURFACE STRUCTURE;

FULL CONFIGURATION INTERACTION; GENERALIZED SPIN DENSITY FUNCTIONAL THEORY; GRADIENT CORRECTION; HARTREE-FOCK METHOD; LOCALIZED SPIN DENSITY APPROXIMATION; NONCOLLINEAR MOLECULAR MAGNETISM; SELF INTERACTION CORRECTION;

QUANTUM THEORY;

EID: 0035890873 PISSN: 00207608 EISSN: None Source Type: Journal
DOI: 10.1002/qua.1507 Document Type: Conference Paper

Times cited : (18)

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