Vertical and adiabatic ionization potentials of fluorinated, chlorinated, and chlorofluorinated ethylenes using G2 and G3 theories

Journal of Physical Chemistry A

Volumn 111, Issue 22, 2007, Pages 4836-4848

  Pradie, Noriberto A ^a   Linnert, Harrald V ^a  

^a UNIVERSITY OF SÃO PAULO   (Brazil)

Author keywords

[No Author keywords available]

Indexed keywords

CHEMICAL RELAXATION; DERIVATIVES; HALOGENATION; IONIZATION POTENTIAL; MOLECULAR ORBITALS;

ADIABATIC IONIZATION POTENTIALS; ELECTRONIC CORRELATION; FLUOROETHYLENES; ORBITAL RELAXATION; ZERO-POINT ENERGIES;

ETHYLENE;

EID: 34250762554     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp061683t     Document Type: Article

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