Semiexperimental equilibrium structure for cis, trans -1,4- difluorobutadiene by the mixed estimation method

Journal of Physical Chemistry A

Volumn 115, Issue 27, 2011, Pages 8049-8054

  Demaison, Jean F ^a   Craig, Norman C ^b  

^a UNIVERSITÉ DES SCIENCES ET TECHNOLOGIES DE LILLE   (France)

^b OBERLIN COLLEGE   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO; AB INITIO CALCULATIONS; COUPLED CLUSTERS; EQUILIBRIUM STRUCTURES; ESTIMATION METHODS; FORCE FIELDS; ROTATIONAL CONSTANTS; STRUCTURAL PARAMETER; WEIGHTED LEAST SQUARES;

CALCULATIONS;

EQUILIBRIUM CONSTANTS;

1,3 BUTADIENE DERIVATIVE; FLUORINATED HYDROCARBON;

ARTICLE; CHEMICAL MODEL; CHEMICAL STRUCTURE; CHEMISTRY; ISOMERISM;

BUTADIENES; HYDROCARBONS, FLUORINATED; ISOMERISM; MODELS, CHEMICAL; MOLECULAR STRUCTURE;

EID: 79960139933     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp203575r     Document Type: Article

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