CASSCF and CCI calculations of the vibrational band strengths of HCN

1985 ◽  
Vol 83 (6) ◽  
pp. 3034-3041 ◽  
Author(s):  
Uffe G. Jo/rgensen ◽  
Jan Almlöf ◽  
Bengt Gustafsson ◽  
Mats Larsson ◽  
Per Siegbahn
Keyword(s):  
RSC Advances ◽  
2021 ◽  
Vol 11 (6) ◽  
pp. 3613-3621
Author(s):  
Yonghong Xu ◽  
Huihui Wang ◽  
Yonggang Yang ◽  
Changyong Li ◽  
Liantuan Xiao ◽  
...  

The band structures of the vibrational energy levels of B11− lead to corresponding spectral broadening. The vibrational band-structures of planar boron rotors are caused by internal rotations.


2020 ◽  
Vol 1643 ◽  
pp. 012122
Author(s):  
M.M.R. Chishti ◽  
D. O’Donnell ◽  
G. Battaglia ◽  
M. Bowry ◽  
D.A. Jaroszynski ◽  
...  

Author(s):  
Katharina A. E. Meyer ◽  
Arman Nejad

The cis–trans-isomerism of the propiolic acid monomer (HCC–COOH) is examined with linear Raman jet spectroscopy, yielding the first environment-free vibrational band centres of a higher-energy cis-rotamer beyond formic acid (HCOOH) in addition to all fundamentals and a large number of hot and combination/overtone bands of the trans-conformer.


1973 ◽  
Vol 44 (1) ◽  
pp. 39-40 ◽  
Author(s):  
D. Ward ◽  
R.L. Graham ◽  
J.S. Geiger ◽  
H.R. Andrews

1993 ◽  
Vol 99 (12) ◽  
pp. 9389-9393 ◽  
Author(s):  
G. Moser ◽  
A. Asenbaum ◽  
G. Döge

1994 ◽  
Vol 167 (2) ◽  
pp. 365-374 ◽  
Author(s):  
T.M. Goyette ◽  
C.D. Paulse ◽  
L.C. Oesterling ◽  
F.C. Delucia ◽  
P. Helminger
Keyword(s):  

2001 ◽  
Vol 349 (1-2) ◽  
pp. 131-136 ◽  
Author(s):  
Sheng-Gui He ◽  
Hai Lin ◽  
Walter Thiel ◽  
Qing-Shi Zhu

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