PH3 revisited: Theoretical transition moments for the vibrational transitions below 7000 cm- 1

Journal of Molecular Spectroscopy

Volumn 252, Issue 2, 2008, Pages 121-128

  Ovsyannikov, Roman I ^a   Thiel, Walter ^b   Yurchenko, Sergei N ^c   Carvajal, Miguel ^d   Jensen, Per ^a  

^a UNIVERSITY OF WUPPERTAL   (Germany)

^b MAX PLANCK INSTITUT FÜR KOHLENFORSCHUNG   (Germany)

^c DRESDEN UNIVERSITY OF TECHNOLOGY   (Germany)

^d UNIVERSITY OF HUELVA   (Spain)

Author keywords

Ab initio; Local modes; PH3; Phosphine; Transition moments; Variational calculations; Vibrational spectra

Indexed keywords

MOLECULAR SPECTROSCOPY; PHOSPHORUS COMPOUNDS; POTENTIAL ENERGY SURFACES; QUANTUM CHEMISTRY; VARIATIONAL TECHNIQUES;

AB INITIO; LOCAL MODES; PHOSPHINE; TRANSITION MOMENTS; VARIATIONAL CALCULATIONS;

POTENTIAL ENERGY;

EID: 55949137593     PISSN: 00222852     EISSN: 1096083X     Source Type: Journal    
DOI: 10.1016/j.jms.2008.07.005     Document Type: Article

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