Generation of molecular symmetry orbitals for the point and double groups

Computer Physics Communications

Volumn 171, Issue 2, 2005, Pages 119-132

  Rykhlinskaya, K ^a   Fritzsche, S ^a  

^a UNIVERSITY OF KASSEL   (Germany)

Author keywords

Atomic and molecular orbital; Double group; Point group; Projection operator; Symmetry orbital

Indexed keywords

ALGEBRA; ATOMS; COMPUTATIONAL METHODS; NUMERICAL METHODS; POINT GROUPS;

ATOMIC AND MOLECULAR ORBITALS; DOUBLE GROUPS; PROJECTION OPERATORS; SYMMETRY ORBITAL;

MOLECULAR PHYSICS;

EID: 24144456549     PISSN: 00104655     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cpc.2005.03.112     Document Type: Article

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