Intensities of the vibrational spectra of siliceous zeolites by molecular dynamics calculations. I. Infrared spectra

Journal of Physical Chemistry B

Volumn 105, Issue 1, 2001, Pages 36-41

  Bornhauser, P ^a,c   Bougeard, D ^a,b  

^a USTL Bât C5   (France)

^b UNIV LILLE   (France)

^c ADAM MICKIEWICZ UNIVERSITY   (Poland)

Author keywords

[No Author keywords available]

Indexed keywords

CHEMICAL BONDS; ELECTROOPTICAL EFFECTS; FREQUENCIES; INFRARED SPECTROSCOPY; MATHEMATICAL MODELS; MOLECULAR DYNAMICS; MOLECULAR SPECTROSCOPY; MOLECULAR VIBRATIONS; NUMERICAL ANALYSIS; SILICA;

DIPOLE MOMENT; FAUJASITE; INFRARED INTENSITIES; SILICALITE; SILICEOUS ZEOLITES; SODALITE; VIBRATIONAL SPECTRA;

ZEOLITES;

EID: 0035130049     PISSN: 10895647     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp0014925     Document Type: Article

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