Accurate ab initio based DMBE potential energy surface for the ground electronic state of N2 H2

Journal of Chemical Physics

Volumn 131, Issue 4, 2009, Pages

  Poveda, L A ^a   Biczysko, M ^a,b   Varandas, A J C ^a  

^a UNIVERSITY OF COIMBRA   (Portugal)

^b UNIVERSITY OF NAPLES FEDERICO II   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO; CLUSTER EXPANSION; DIAZENES; DISSOCIATION LIMIT; DOUBLE MANY-BODY EXPANSIONS; GROUND ELECTRONIC STATE; MOLECULAR POTENTIAL; STATIONARY POINTS; THREE-BODY SYSTEMS;

ELECTRONIC STATES; POTENTIAL ENERGY SURFACES; QUANTUM CHEMISTRY; SWITCHING FUNCTIONS;

POTENTIAL ENERGY;

EID: 68249112026     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3176512     Document Type: Article

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