Quantum Monte Carlo studies on small molecules

Molecular Physics

Volumn 104, Issue 19, 2006, Pages 3069-3085

  Galek, Peter T A ^a   Handy, Nicholas C ^a   Lester Jr , William A ^b  

^a UNIVERSITY OF CAMBRIDGE   (United Kingdom)

^b UNIVERSITY OF CALIFORNIA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ALGORITHMS; CORRELATION METHODS; DISSOCIATION; FUNCTION EVALUATION; MOLECULAR DYNAMICS; OPTIMIZATION; QUANTUM THEORY;

DISSOCIATION ENERGIES; FIXED-NODE DIFFUSION MONTE CARLO (FNDMC) METHODS; IONIZATION POTENTIALS; SLATER-TYPE ORBITALS (STO);

MONTE CARLO METHODS;

EID: 33750568200     PISSN: 00268976     EISSN: 13623028     Source Type: Journal    
DOI: 10.1080/00268970600962071     Document Type: Article

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