A quantum reaction dynamics study of the translational, vibrational, and rotational motion effects on the HD + H3+ reaction

2011 ◽  
Vol 135 (11) ◽  
pp. 114307 ◽  
Author(s):  
Fanbin Meng ◽  
Tingting Wang ◽  
Dunyou Wang
Keyword(s):  
Rotational Motion ◽  
Reaction Dynamics ◽  
Quantum Reaction

On theJ-Shift Approximation in Quantum Reaction Dynamics

1999 ◽  
Vol 103 (34) ◽  
pp. 6715-6720 ◽  
Author(s):  
Katsuyuki Nobusada ◽  
Hiroki Nakamura
Keyword(s):  
Reaction Dynamics ◽  
Quantum Reaction

scholarly journals Dissociative adsorption of H2 on Cu(100): A four-dimensional study of the effect of rotational motion on the reaction dynamics

1997 ◽  
Vol 106 (10) ◽  
pp. 4248-4259 ◽  
Author(s):  
R. C. Mowrey ◽  
G. J. Kroes ◽  
G. Wiesenekker ◽  
E. J. Baerends
Keyword(s):  
Rotational Motion ◽  
Reaction Dynamics ◽  
Dissociative Adsorption

A fully state- and angle-resolved study of the H+HD→D+H2 reaction: Comparison of a molecular beam experiment to ab initio quantum reaction dynamics

2002 ◽  
Vol 117 (18) ◽  
pp. 8341-8361 ◽  
Author(s):  
Sheng Der Chao ◽  
Steven A. Harich ◽  
Dong Xu Dai ◽  
Chia C. Wang ◽  
Xueming Yang ◽  
...  
Keyword(s):  
Ab Initio ◽  
Molecular Beam ◽  
Reaction Dynamics ◽  
Beam Experiment ◽  
Quantum Reaction

scholarly journals Born–Oppenheimer and Renner–Teller coupled-channel quantum reaction dynamics of O(3P) + H2+(X2Σg+) collisions

2015 ◽  
Vol 17 (36) ◽  
pp. 23392-23402 ◽  
Author(s):  
Pablo Gamallo ◽  
Paolo Defazio ◽  
Miguel González ◽  
Miguel Paniagua ◽  
Carlo Petrongolo
Keyword(s):  
Quantum Dynamics ◽  
Reaction Dynamics ◽  
Time Dependent ◽  
Quantum Reaction ◽  
Coupled Channel

We present Born–Oppenheimer (BO) and Renner–Teller (RT) time dependent quantum dynamics studies of the reactions O(3P) + H2+(X2Σg+) → OH+(X3Σ−) + H(2S) and OH(X2Π) + H+.

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