Efficient evaluation of the Coulomb force in density-functional theory calculations

Journal of Chemical Physics

Volumn 114, Issue 15, 2001, Pages 6572-6577

  Shao, Yihan ^a   White, Christopher A ^b   Head Gordon, Martin ^a  

^a UNIVERSITY OF CALIFORNIA   (United States)

^b AGERE SYSTEMS   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

KINETIC ENERGY; NUMERICAL METHODS; ORGANIC COMPOUNDS; PROBABILITY DENSITY FUNCTION;

CONTINOUS FAST MULTIPLE METHOD; COULOMB FORCE; DENSITY FUNCTIONAL THEORY; QUANTUM CHEMISTRY METHODS;

QUANTUM THEORY;

EID: 0035870738     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1357441     Document Type: Article

References (25)