Vibrational spectra obtained from high quality potential energy surfaces spanned by low level normal coordinates: Application to CHFClI and CDFClI

Molecular Physics

Volumn 105, Issue 10, 2007, Pages 1385-1394

  Heislbetz, Sandra ^a   Schwerdtfeger, Peter ^b   Rauhut, Guntram ^a  

^a UNIVERSITY OF STUTTGART   (Germany)

^b MASSEY UNIVERSITY   (New Zealand)

Author keywords

[No Author keywords available]

Indexed keywords

APPROXIMATION THEORY; GEOMETRY; HARMONIC ANALYSIS; MOLECULAR INTERACTIONS; VIBRATIONAL SPECTRA;

HARMONIC FREQUENCY CALCULATIONS; PARITY VIOLATION EFFECTS; SPANNING HIGH LEVEL POTENTIAL ENERGY SURFACES;

POTENTIAL ENERGY;

EID: 34547838668     PISSN: 00268976     EISSN: 13623028     Source Type: Journal    
DOI: 10.1080/00268970701348741     Document Type: Article

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