Liquid structure, infrared and isotropic/anisotropic Raman noncoincidence of the amide I band, and low-wavenumber vibrational spectra of liquid formamide: Molecular dynamics and ab initio molecular orbital studies

Journal of Physical Chemistry B

Volumn 102, Issue 1, 1998, Pages 315-321

  Torii, Hajime ^a   Tasumi, Mitsuo ^a,b  

^a UNIVERSITY OF TOKYO   (Japan)

^b SAITAMA UNIVERSITY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

HYDROGEN BONDS; INFRARED SPECTROSCOPY; MOLECULAR DYNAMICS; MOLECULAR SPECTROSCOPY; MOLECULAR STRUCTURE; MOLECULAR VIBRATIONS; NUMERICAL ANALYSIS; RAMAN SPECTROSCOPY;

AB INITIO MOLECULAR ORBITAL CALCULATIONS; FORMAMIDE; LIQUID STRUCTURE; WAVENUMBER DIFFERENCE;

ORGANIC COMPOUNDS;

EID: 0031672534     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp972880i     Document Type: Article

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