scholarly journals Geometric phase effects in low-energy dynamics near conical intersections: A study of the multidimensional linear vibronic coupling model

2013 ◽  
Vol 139 (23) ◽  
pp. 234103 ◽  
Author(s):  
Loïc Joubert-Doriol ◽  
Ilya G. Ryabinkin ◽  
Artur F. Izmaylov
1988 ◽  
Vol 53 (6) ◽  
pp. 1134-1140
Author(s):  
Martin Breza ◽  
Peter Pelikán

It is suggested that for some transition metal hexahalo complexes, the Eg-(a1g + eg) vibronic coupling model is better suited than the classical T2g-(a1g + eg) model. For the former, alternative model, the potential constants in the analytical formula are evaluated from the numerical map of the adiabatic potential surface by using the linear regression method. The numerical values for 29 hexahalo complexes of the 1st row transition metals are obtained by the CNDO/2 method. Some interesting trends of parameters of such Jahn-Teller-active systems are disclosed.


2007 ◽  
Vol 310 (2) ◽  
pp. e454-e456
Author(s):  
V.N. Glazkov ◽  
A.I. Smirnov ◽  
A. Kolezhuk ◽  
H. Tanaka ◽  
A. Oosawa

2000 ◽  
Author(s):  
Neil Lambert ◽  
I. Sachs
Keyword(s):  

ChemInform ◽  
2010 ◽  
Vol 24 (33) ◽  
pp. no-no
Author(s):  
M. J. RILEY ◽  
A. FURLAN ◽  
H. U. GUEDEL ◽  
S. LEUTWYLER

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