The utility of constraining basis function indices when using the lanczos algorithm to calculate vibrational energy levels

Journal of Physical Chemistry A

Volumn 105, Issue 12, 2001, Pages 2575-2581

  Wang, Xiao Gang ^a   Carrington Jr , Tucker ^a  

^a UNIVERSITÉ DE MONTRÉAL   (Canada)

Author keywords

[No Author keywords available]

Indexed keywords

VIBRATIONAL ENERGY LEVELS;

ALGORITHMS; CONSTRAINT THEORY; ELECTRON ENERGY LEVELS; FUNCTIONS; HAMILTONIANS; MATRIX ALGEBRA;

MOLECULAR VIBRATIONS;

EID: 0035967357     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp003792s     Document Type: Article

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