Toward the modeling of the NO2(2A″) manifold

International Journal of Quantum Chemistry

Volumn 111, Issue 14, 2011, Pages 3776-3785

  Mota, V C ^a   Caridade, P J S B ^a   Varandas, A J C ^a  

^a UNIVERSITY OF COIMBRA   (Portugal)

Author keywords

conical intersections; diabatization methods; electronic manifolds; global potential energy surface; NO2

Indexed keywords

AB INITIO; ADIABATS; ASYMPTOTIC LIMITS; CONFIGURATION SPACE; CONICAL INTERSECTION; DIABATIC POTENTIALS; DIABATIZATION METHODS; DIABATS; DOUBLE MANY-BODY EXPANSIONS; ELECTRONIC MANIFOLDS; GLOBAL POTENTIAL ENERGY SURFACE; MATRIX;

QUANTUM CHEMISTRY;

NITROGEN OXIDES;

EID: 80052080207     PISSN: 00207608     EISSN: 1097461X     Source Type: Journal    
DOI: 10.1002/qua.22907     Document Type: Article

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