scholarly journals Matrix-Isolation Study and Ab Initio Calculations of the Structure and Spectra of Hydroxyacetone

2008 ◽  
Vol 112 (26) ◽  
pp. 5935-5946 ◽  
Author(s):  
Archna Sharma ◽  
Igor Reva ◽  
Rui Fausto
Keyword(s):  
Ab Initio Calculations ◽  
Ab Initio ◽  
Matrix Isolation

Vibrational Spectra and Structure of CH3Cl:H2O, CH3Cl:HDO, and CH3Cl:D2O Complexes. IR Matrix Isolation and ab initio Calculations

2005 ◽  
Vol 109 (45) ◽  
pp. 10273-10279 ◽  
Author(s):  
Nadia Dozova ◽  
Lahouari Krim ◽  
M. Esmaïl Alikhani ◽  
Nelly Lacome
Keyword(s):  
Ab Initio Calculations ◽  
Ab Initio ◽  
Vibrational Spectra ◽  
Matrix Isolation

Vibrational Spectra and Structure of CH3Cl:(H2O)2and CH3Cl:(D2O)2Complexes. IR Matrix Isolation and ab Initio Calculations

2007 ◽  
Vol 111 (40) ◽  
pp. 10055-10061 ◽  
Author(s):  
Nadia Dozova ◽  
Lahouari Krim ◽  
M. Esmaï l Alikhani ◽  
Nelly Lacome
Keyword(s):  
Ab Initio Calculations ◽  
Ab Initio ◽  
Vibrational Spectra ◽  
Matrix Isolation

The vibrational spectra, including matrix isolation, conformations and ab initio calculations of bromomethyl dimethyl chlorosilane

1997 ◽  
Vol 410-411 ◽  
pp. 477-481
Author(s):  
Gamil A. Guirgis ◽  
A. Nilsen ◽  
P. Klaeboe ◽  
V. Aleksa ◽  
C.J. Nielsen ◽  
...  
Keyword(s):  
Ab Initio Calculations ◽  
Ab Initio ◽  
Vibrational Spectra ◽  
Matrix Isolation

Generation, Direct Observation under Matrix Isolation Conditions, and ab Initio Calculations for 2-Azacyclopenta-2,4-dien-1-one

1995 ◽  
Vol 99 (43) ◽  
pp. 15870-15873 ◽  
Author(s):  
Dana Lyn S. Yokotsuji ◽  
William P. Dailey ◽  
Andrew S. Kende ◽  
Liviu Birzan ◽  
Kun Liu
Keyword(s):  
Ab Initio Calculations ◽  
Ab Initio ◽  
Direct Observation ◽  
Matrix Isolation
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