Pseudo Jahn-Teller origin of bending instability of triatomic molecules

Journal of Molecular Structure

Volumn 1023, Issue , 2012, Pages 108-114

  Kayi, Hakan ^a   Bersuker, Isaac B ^a   Boggs, James E ^a  

^a UNIVERSITY OF TEXAS AT AUSTIN   (United States)

Author keywords

Linear molecules; Pseudo Jahn Teller effect; Renner Teller effect; Vibronic coupling

Indexed keywords

AB INITIO; AB INITIO CALCULATIONS; BENDING INSTABILITY; DEGENERATE STATE; ENERGY PROFILE; EQUILIBRIUM GEOMETRIES; EXPERIMENTAL OBSERVATION; GENERAL TRENDS; JAHN-TELLER; LINEAR CONFIGURATION; LINEAR MOLECULES; RENNER-TELLER EFFECT; SPECTROSCOPIC PROPERTY; TRIATOMIC MOLECULES; TRIATOMIC SYSTEMS; VIBRONIC COUPLING; VIBRONIC COUPLING CONSTANTS;

ELECTRONIC STRUCTURE; JAHN-TELLER EFFECT; MOLECULES;

CALCULATIONS;

EID: 84864630239     PISSN: 00222860     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.molstruc.2012.03.072     Document Type: Article

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