Improving the accuracy of ab initio methods with summation approximants and singularity analysis

International Journal of Quantum Chemistry

Volumn 92, Issue 1, 2003, Pages 35-46

  Goodson, David Z ^a  

^a UNIVERSITY OF MASSACHUSETTS DARTMOUTH   (United States)

Author keywords

Ab initio methods; Coupled cluster theory; Full configuration interaction; MP perturbation theory; Scaling

Indexed keywords

APPROXIMATION THEORY; COMPUTATIONAL METHODS; ELECTRON RESONANCE; ELECTRONIC STRUCTURE; PERTURBATION TECHNIQUES;

COUPLED CLUSTER THEORY; FULL CONFIGURATION INTERACTION; MOLLET PLESSET PERTURBATION THEORY; RESONANCE ENERGIES; SINGULARITY ANALYSIS; SUMMATION APPROXIMANTS;

QUANTUM THEORY;

EID: 0037420057     PISSN: 00207608     EISSN: None     Source Type: Journal    
DOI: 10.1002/qua.10489     Document Type: Article

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