Spin-orbit effects in the ground states of singly positive and neutral V 2, VNB, and Nb 2: INDO/S and empirical model calculations

Journal of Physical Chemistry A

Volumn 108, Issue 23, 2004, Pages 5016-5025

  O'Brien, Ted A ^a,b,c  

^a UNIVERSITY OF FLORIDA   (United States)

^b INDIANA UNIVERSITY   (United States)

^c INDIANA UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

OPTICAL SPECTROSCOPY; SECOND-ORDER PERTURBATION THEORY; WAVE FUNCTIONS;

APPROXIMATION THEORY; CATALYSIS; GROUND STATE; HAMILTONIANS; ITERATIVE METHODS; MATHEMATICAL MODELS; MOLECULAR DYNAMICS; POSITIVE IONS;

TRANSITION METAL COMPOUNDS;

EID: 3042543626     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp014108s     Document Type: Article

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