Multiresolution quantum chemistry in multiwavelet bases: Hartree-Fock exchange

Journal of Chemical Physics

Volumn 121, Issue 14, 2004, Pages 6680-6688

  Yanai, Takeshi ^a   Fann, George I ^a   Gan, Zhenting ^a   Harrison, Robert J ^a   Beylkin, Gregory ^b  

^a OAK RIDGE NATIONAL LABORATORY   (United States)

^b UNIVERSITY OF COLORADO   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

HARTREE-FOCK (HF) EXCHANGE; INTEGRAL CONVOLUTION; MULTIWAVELET REPRESENTATION; NUMERICAL ALGORITHM;

APPROXIMATION THEORY; ASYMPTOTIC STABILITY; CARRIER CONCENTRATION; COMPUTATIONAL METHODS; CONVOLUTION; INTEGRAL EQUATIONS; MATHEMATICAL MODELS; MATHEMATICAL OPERATORS; MATRIX ALGEBRA; MOLECULAR DYNAMICS; WATER;

ALGORITHMS;

EID: 7544240157     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1790931     Document Type: Article

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