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Journal of Computational Chemistry

Volumn 23, Issue 8, 2002, Pages 779-785

Spin densities in two-component relativistic density functional calculations: Noncollinear versus collinear approach

(1) Van Wüllen, Christoph a

a TECHNISCHE UNIVERSITÄT BERLIN (Germany)

Author keywords

Collinear; Density functional; Noncollinear; Open shell; Relativistic; Spin density

Indexed keywords

APPROXIMATION THEORY; CALCULATIONS; CARRIER CONCENTRATION; CORRELATION METHODS; ELECTRIC POTENTIAL; ELECTRON ENERGY LEVELS; IONIZATION; MAGNETIZATION; MOLECULAR ORIENTATION; PROBABILITY DENSITY FUNCTION;

QUANTIZATION; SPIN DENSITY;

QUANTUM THEORY;

EID: 0036605513 PISSN: 01928651 EISSN: None Source Type: Journal
DOI: 10.1002/jcc.10043 Document Type: Article

Times cited : (152)

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* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.