A singularity excluded approximate expansion scheme in relativistic density functional theory

Theoretical Chemistry Accounts

Volumn 108, Issue 1, 2002, Pages 53-60

  Wang, Fan ^a   Li, Le Min ^a  

^a Peking University   (China)

Author keywords

Approximate expansion; Density functional theory; Dirac operator; Kohn Sham equation; Quantum chemical calculations; Relativistic effects

Indexed keywords

ARTICLE; CALCULATION; DENSITY; QUANTUM CHEMISTRY;

EID: 0036024499     PISSN: 1432881X     EISSN: None     Source Type: Journal    
DOI: 10.1007/s00214-002-0358-6     Document Type: Article

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