Nonsymmuetrical perturbation theory for improving coupled-cluster wave functions

International Journal of Quantum Chemistry

Volumn 90, Issue 4-5, 2002, Pages 1309-1320

  Whittaker, James W ^a  

^a OREGON HEALTH AND SCIENCE UNIVERSITY   (United States)

Author keywords

Coupled cluster calculations; Nonsymmetrical perturbation theory; Partitioning

Indexed keywords

ELECTRON ENERGY LEVELS; GEOMETRY; HAMILTONIANS; LINEAR EQUATIONS; MATHEMATICAL OPERATORS; MOLECULES; OPTIMIZATION; PERTURBATION TECHNIQUES; POTENTIAL ENERGY;

COUPLED-CLUSTER WAVE FUNCTIONS; MULTIREFERENCE PERTURBATION TECHNIQUES (MRFT);

QUANTUM THEORY;

EID: 0037112462     PISSN: 00207608     EISSN: None     Source Type: Journal    
DOI: 10.1002/qua.10382     Document Type: Conference Paper

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