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Chinese Academy of Sciences Institutional Repositories Grid
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CAS IR Grid
机构
大连化学物理研究所 [3]
武汉物理与数学研究所 [1]
采集方式
OAI收割 [4]
内容类型
期刊论文 [4]
发表日期
2012 [1]
2009 [3]
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An eight-dimensional quantum mechanical Hamiltonian for X+YCZ(3) system and its applications to H+CH4 reaction
期刊论文
OAI收割
JOURNAL OF CHEMICAL PHYSICS, 2012, 卷号: 137, 期号: 17
作者:
Liu, Rui
;
Xiong, Hongwei
;
Yang, Minghui
收藏
  |  
浏览/下载:32/0
  |  
提交时间:2015/06/25
atom-molecule reactions
excited states
heat of reaction
hydrogen neutral atoms
organic compounds
potential energy surfaces
quantum chemistry
reaction rate constants
vibrational states
A five-dimensional quantum dynamics study of the F(P-2)+CH4 reaction
期刊论文
OAI收割
journal of chemical physics, 2009, 卷号: 131, 期号: 24
作者:
Chu, Tianshu
;
Han, Keli
收藏
  |  
浏览/下载:16/0
  |  
提交时间:2015/11/12
angular momentum
atom-molecule reactions
fluorine
ground states
organic compounds
potential energy surfaces
reaction kinetics theory
reaction rate constants
resonant states
rotational-vibrational states
Comparison of second-order split operator and Chebyshev propagator in wave packet based state-to-state reactive scattering calculations (vol 130, 174102, 2009)
期刊论文
OAI收割
journal of chemical physics, 2009, 卷号: 131, 期号: 4
作者:
Sun, Zhigang
;
Lee, Soo-Y.
收藏
  |  
浏览/下载:20/0
  |  
提交时间:2015/11/12
atom-molecule reactions
hydrogen compounds
hydrogen neutral atoms
reaction kinetics theory
Nonadiabatic effects in the H+H-2 exchange reaction: Accurate quantum dynamics calculations at a state-to-state level
期刊论文
OAI收割
journal of chemical physics, 2009, 卷号: 130, 期号: 14
作者:
Chu, Tian-Shu
;
Han, Ke-Li
;
Hankel, Marlies
;
Balint-Kurti, Gabriel G.
;
Kuppermann, Aron
收藏
  |  
浏览/下载:25/0
  |  
提交时间:2015/11/12
atom-molecule reactions
chemical exchanges
ground states
hydrogen neutral atoms
hydrogen neutral molecules
potential energy surfaces
reaction kinetics theory
vibrational modes