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大连化学物理研究所 [4]
清华大学 [3]
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期刊论文 [13]
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Non-adiabatic state-to-state dynamic studies of Na(3p) + H-2(nu=1, 2, 3; j=0) -> NaH plus H reactions
期刊论文
CHEMICAL PHYSICS LETTERS, 2019, 卷号: 723, 页码: 128-132
作者:
Buren, Bayaer
;
Yang, Zijiang
;
Chen, Maodu
收藏
  |  
浏览/下载:9/0
  |  
提交时间:2019/12/02
Time-dependent wave packet method
Non-adiabatic state-to-state reaction
Ro-vibrational state distribution
Integral cross section
Non-adiabatic quantum dynamical studies of Na(3p) + HD(nu=1, j=0)-> NaH/NaD plus D/H reaction
期刊论文
CHINESE PHYSICS B, 2019, 卷号: 28
作者:
Wen, Yue-Pei
;
Buren, Bayaer
;
Chen, Mao-Du
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2019/12/02
time-dependent wave packet method
non-adiabatic reaction
integral cross section
differential cross section
Dynamical resonances in F + H-2/HD reaction scattering
期刊论文
THEORETICAL CHEMISTRY ACCOUNTS, 2018, 卷号: 137, 期号: 2
作者:
Li, Xueming
;
Sun, Zhigang
收藏
  |  
浏览/下载:8/0
  |  
提交时间:2019/06/20
Reactive Resonance
Quantum Reaction Dynamics
Time-dependent Wave Packet Method
Differential Cross Sections for the H+D2O -> HD+OD Reaction: a Full Dimensional State-to-State Quantum Dynamics Study
期刊论文
CHINESE JOURNAL OF CHEMICAL PHYSICS, 2017, 卷号: 30, 期号: 1, 页码: 16-24
作者:
Zhao, Zhi-qiang
;
Zhang, Dong H.
;
Liu, Shu
收藏
  |  
浏览/下载:14/0
  |  
提交时间:2019/06/20
State-to-state
Differential Cross Section
Time-dependent Wave-packet Method
Quantum Dynamics Study on D+OD+ Reaction: Competition between Exchange and Abstraction Channels
期刊论文
chinese journal of chemical physics, 2013, 卷号: 26, 期号: 1, 页码: 73-76
作者:
Xu, Wen-wu
;
Zhang, Pei-yu
;
He, Guo-zhong
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  |  
浏览/下载:17/0
  |  
提交时间:2014/09/11
Time-dependent quantum wave packet method
Potential energy surface
D+OD+ reaction
A full-dimensional time-dependent wave packet study of the OH+CO -> H+CO2 reaction
期刊论文
theoretical chemistry accounts, 2012, 卷号: 131, 期号: 1
作者:
Liu, Shu
;
Xu, Xin
;
Zhang, Dong H.
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  |  
浏览/下载:7/0
  |  
提交时间:2015/11/13
Complex-forming reactions
Quantum scattering
Reaction resonance
Time-dependent wave packet method
Theoretical study of the molecular super-excited states: assignment and theoretical relative intensities of the photofragment yield spectra for F/sup -/ from F/sub 2/ ion-pair production
期刊论文
2010, 2010
Zhang Wei-Hua
;
He Chun-Long
;
Hao Yu-Song
;
Mo Yu-Xiang
;
Li Jia-Ming
收藏
  |  
浏览/下载:5/0
The theoretical study of molecular super-excited state: the study of the photofragment yield spectrum for F/sup -/ from the F/sub 2 / ion-pair production
期刊论文
2010, 2010
Zhang Wei-Hua
;
Mo Yu-Xiang
;
Li Jia-Ming
收藏
  |  
浏览/下载:3/0
Theoretical analysis of time-dependent wave-packet dynamics: Proton impact excitation (2s-2p) with Li atom
期刊论文
2010, 2010
Chen Shao-Hao
;
Wang Feng
;
Li Jia-Ming
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  |  
浏览/下载:2/0
Surface Corrugation in Rotational and Diffractive Scattering of O(2) from LiF (001)
期刊论文
Communications in Theoretical Physics, 2010, 卷号: 54, 期号: 6, 页码: 1112-1120
K. Xu
;
X. R. Chen
;
D. Q. Wei
;
Q. Q. Gou
收藏
  |  
浏览/下载:12/0
  |  
提交时间:2012/04/13
molecule-surface scattering
surface corrugation
multi-configuration
time-dependent Hartree method
time-dependent hartree
potential-energy surfaces
propagating
wavepackets
product representation
inelastic-scattering
metal-surface
wave-packet
h-2
lif(001)
simulations
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