Correlated ab initio calculations of spectroscopic parameters of SnO within the framework of the higher-order generalized Douglas-Kroll transformation

Journal of Chemical Physics

Volumn 120, Issue 18, 2004, Pages 8624-8631

  Wolf, Alexander ^a,b   Reiher, Markus ^a,b   Hess, Bernd Artur ^a,b  

^a UNIVERSITY OF ERLANGEN NUREMBERG   (Germany)

^b UNIVERSITY OF BONN   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

CHEMICAL BONDS; DISSOCIATION; ELECTRON ENERGY LEVELS; ELECTRONIC STRUCTURE; ELECTRONS; HAMILTONIANS; ITERATIVE METHODS; MOLECULAR ORIENTATION; MOLECULAR SPECTROSCOPY; NEGATIVE IONS; QUANTUM THEORY;

DISSOCIATION ENERGY; DOUGLAS-KROLL TRANSFORMATION; HEAVY ATOMS; QUANTUM CHEMISTRY;

TIN COMPOUNDS;

EID: 2542430268     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1690757     Document Type: Article

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