scholarly journals Conical Intersection and Potential Energy Surface Features of a Model Retinal Chromophore: Comparison of EOM-CC and Multireference Methods

2012 ◽  
Vol 9 (1) ◽  
pp. 284-292 ◽  
Author(s):  
Samer Gozem ◽  
Anna I. Krylov ◽  
Massimo Olivucci
Keyword(s):  
Potential Energy ◽  
Potential Energy Surface ◽  
Energy Surface ◽  
Conical Intersection ◽  
Surface Features ◽  
Retinal Chromophore ◽  
Multireference Methods

Spin–orbit corrected potential energy surface features for the I (2P3/2) + H2O → HI + OH forward and reverse reactions

2014 ◽  
Vol 16 (6) ◽  
pp. 2641 ◽  
Author(s):  
Yanjun Hao ◽  
Jiande Gu ◽  
Yundong Guo ◽  
Meiling Zhang ◽  
Yaoming Xie ◽  
...  
Keyword(s):  
Potential Energy ◽  
Potential Energy Surface ◽  
Energy Surface ◽  
Spin Orbit ◽  
Surface Features

New Potential Energy Surface Features for the Li + HF → LiF + H Reaction

2013 ◽  
Vol 117 (39) ◽  
pp. 10027-10033 ◽  
Author(s):  
Qunchao Fan ◽  
Huidong Li ◽  
Hao Feng ◽  
Weiguo Sun ◽  
Tongxiang Lu ◽  
...  
Keyword(s):  
Potential Energy ◽  
Potential Energy Surface ◽  
Energy Surface ◽  
Surface Features
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