Calculating vibrational energies and wave functions of vinylidene using a contracted basis with a locally reorthogonalized coupled two-term Lanczos eigensolver

Journal of Chemical Physics

Volumn 125, Issue 9, 2006, Pages

  Tremblay, Jean Christophe ^a   Carrington Jr , Tucker ^a  

^a UNIVERSITÉ DE MONTRÉAL   (Canada)

Author keywords

[No Author keywords available]

Indexed keywords

ACETYLENE; COMPUTATIONAL METHODS; EIGENVALUES AND EIGENFUNCTIONS; FUNCTION EVALUATION; MOLECULAR VIBRATIONS; VECTORS;

TWO TERM LANCZOS EIGENSOLVERS; VIBRATIONAL ENERGIES; VIBRATIONAL STATES; WAVE FUNCTIONS;

OLEFINS;

EID: 33748558835     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2234480     Document Type: Article

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