Ab Initio Calculations of Vibrational Frequencies and Infrared Intensities for Global Warming Potential of CFC Substitutes: CF3CH2F (HFC-134a)

1995 ◽  
Vol 99 (11) ◽  
pp. 3438-3443 ◽  
Author(s):  
Stella Papasavva ◽  
Stephanie Tai ◽  
Amy Esslinger ◽  
Karl H. Illinger ◽  
Jonathan E. Kenny
Keyword(s):  
Global Warming ◽  
Ab Initio Calculations ◽  
Ab Initio ◽  
Global Warming Potential ◽  
Vibrational Frequencies ◽  
Hfc 134A ◽  
Infrared Intensities

The structure of nitrobenzene and the interpretation of the vibrational frequencies of the CNO2 moiety on the basis of ab initio calculations

1994 ◽  
Vol 326 ◽  
pp. 1-16 ◽  
Author(s):  
Vladimir A. Shlyapochnikov ◽  
Leonid S. Khaikin ◽  
Olga E. Grikina ◽  
Charles W. Bock ◽  
Lev V. Vilkov
Keyword(s):  
Ab Initio Calculations ◽  
Ab Initio ◽  
Vibrational Frequencies

Molecular structure and vibrational frequencies of AlxOy (x=1,2; y⩽3) derived from ab initio calculations

1988 ◽  
Vol 144 (4) ◽  
pp. 373-377 ◽  
Author(s):  
J. Masip ◽  
A. Clotet ◽  
J.M. Ricart ◽  
F. Illas ◽  
J. Rubio
Keyword(s):  
Molecular Structure ◽  
Ab Initio Calculations ◽  
Ab Initio ◽  
Vibrational Frequencies
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