High-resolution infrared spectroscopy and ab initio studies of the cyclopropane-carbon dioxide interaction

2006 ◽  
Vol 124 (2) ◽  
pp. 024311 ◽  
Author(s):  
Zheng Su ◽  
Wai Shun Tam ◽  
Yunjie Xu
Keyword(s):  
Carbon Dioxide ◽  
Infrared Spectroscopy ◽  
High Resolution ◽  
Ab Initio

Gas-phase detection of the FCO2 radical by millimeter wave and high resolution infrared spectroscopy assisted by ab initio calculations

2003 ◽  
Vol 118 (3) ◽  
pp. 1214-1220 ◽  
Author(s):  
Zdeněk Zelinger ◽  
Pascal Dréan ◽  
Adam Walters ◽  
Juan Ramon Avilès Moreno ◽  
Marcel Bogey ◽  
...  
Keyword(s):  
Infrared Spectroscopy ◽  
High Resolution ◽  
Ab Initio Calculations ◽  
Ab Initio ◽  
Gas Phase ◽  
Millimeter Wave ◽  
Phase Detection

scholarly journals High-resolution infrared spectroscopy of carbon dioxide dimers, trimers, and larger clusters

2010 ◽  
Vol 108 (17) ◽  
pp. 2195-2205 ◽  
Author(s):  
M. Dehghany ◽  
A.R.W. McKellar ◽  
Mahin Afshari ◽  
N. Moazzen-Ahmadi
Keyword(s):  
Carbon Dioxide ◽  
Infrared Spectroscopy ◽  
High Resolution

High resolution infrared spectroscopy and ab initio calculations of HCN–H2/D2 binary complexes

2001 ◽  
Vol 115 (11) ◽  
pp. 5137-5143 ◽  
Author(s):  
D. T. Moore ◽  
M. Ishiguro ◽  
L. Oudejans ◽  
R. E. Miller
Keyword(s):  
Infrared Spectroscopy ◽  
High Resolution ◽  
Ab Initio Calculations ◽  
Ab Initio ◽  
Binary Complexes

scholarly journals High resolution infrared spectroscopy of carbon dioxide clusters up to (CO2)13

2011 ◽  
Vol 135 (4) ◽  
pp. 044315 ◽  
Author(s):  
J. Norooz Oliaee ◽  
M. Dehghany ◽  
A. R. W. McKellar ◽  
N. Moazzen-Ahmadi
Keyword(s):  
Carbon Dioxide ◽  
Infrared Spectroscopy ◽  
High Resolution ◽  
Carbon Dioxide Clusters

scholarly journals Rovibrational Interaction and Vibrational Constants of the Symmetric Top Molecule14NF3

2013 ◽  
Vol 2013 ◽  
pp. 1-5 ◽  
Author(s):  
Hamid Najib
Keyword(s):  
Fourier Transform ◽  
Infrared Spectroscopy ◽  
High Resolution ◽  
Ab Initio ◽  
Millimeter Wave ◽  
Fourier Transform Infrared ◽  
Interaction Parameters ◽  
Centimeter Wave ◽  
Experimental Values ◽  
Vibrational Constants

Several accurate experimental values of the and rotation-vibration interaction parameters and , , and vibrational constants have been extracted from the most recent high-resolution Fourier transform infrared, millimeter wave, and centimeter wave investigations in the spectra of the oblate symmetric top molecule14NF3. The band-centres used are those of the four fundamental, the overtones, the combination, and hot bands identified in the region between 400 cm−1and 2000 cm−1. Comparison of our constants with the ones measured previously, by infrared spectroscopy at low resolution, reveals orders of magnitude higher accuracy of the new values. The agreement between our values and those determined byab initiocalculations employing the TZ2Pf basis is excellent.

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