The spin-free analogue of Mukherjees state-specific multireference coupled cluster theory

Journal of Chemical Physics

Volumn 134, Issue 5, 2011, Pages

  Datta, Dipayan ^a   Mukherjee, Debashis ^b  

^a UNIVERSITY OF WATERLOO   (Canada)

^b DEPARTMENT OF MATERIALS SCIENCE   (India)

Author keywords

[No Author keywords available]

Indexed keywords

ACTIVE ORBITALS; AMPLITUDE EQUATION; CLOSED SHELLS; CLUSTER OPERATOR; COMPLETE ACTIVE SPACE; CONFIGURATION STATE FUNCTIONS; COUPLED-CLUSTER THEORY; DYNAMICAL CORRELATIONS; EXTENSIVITY; INTRUDER STATE; LINEAR DEPENDENCE; MULTI REFERENCE; MULTIPLE EXCITATIONS; NONDYNAMICAL CORRELATION; NUCLEAR GEOMETRY; NUMERICAL APPLICATIONS; OPEN-SHELL; PARTICLE EXCITATIONS; POWER SERIES EXPANSIONS; SPIN-ORBITALS; WAVE OPERATORS;

CRYSTAL ORIENTATION; NUMERICAL METHODS; QUANTUM CHEMISTRY;

MATHEMATICAL OPERATORS;

EID: 79951519889     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3537740     Document Type: Article

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