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Dynamics studies of O+ + H-2 -> OH+ + H reaction 期刊论文
ACTA PHYSICA SINICA, 2019, 卷号: 68, 期号: 8, 页码: 7
Authors:  Yuan Mei-Ling;  Li Wen-Tao
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OH2+ system  reaction probability  integral cross section  differential cross section  
A new potential energy surface of the LiHO+ system and the dynamics studies of the O + LiH+ reaction 期刊论文
CHEMICAL PHYSICS LETTERS, 2019, 卷号: 715, 页码: 123-128
Authors:  He, Di;  Zhang, Tianqi;  Yuan, Jiuchuan;  Wang, Meishan
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Potential energy surface  Quasi-classical trajectory method  Reaction dynamics  Differential cross section  Integral reaction cross section  
A global potential energy surface and time-dependent quantum wave packet calculation of Au+H-2 reaction 期刊论文
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2018, 卷号: 118, 期号: 3
Authors:  Yuan, Meiling;  Li, Wentao;  Yuan, Jiuchuang;  Chen, Maodu
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Auh2 System  Integral Cross-section  Neural Network  Potential Energy Surface  Time-dependent Wave Packet  
Isotopic effect on the dynamics of the H/D plus LiH/LiD reactions Isotopic effect in the H plus LiH system 期刊论文
COMPUTATIONAL AND THEORETICAL CHEMISTRY, 2016, 卷号: 1084, 页码: 188-195
Authors:  He, Xiaohu;  Zhang, Peiyu;  Duan, Zhi-Xin
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h Plus Lih Reaction  Integral Cross Section  Rate Constants  Isotopic Effect  
Quantum Dynamics of Li plus HF/DF Reaction Investigated by a State-to-State Time-dependent Wave Packet Approach 期刊论文
CHINESE JOURNAL OF CHEMICAL PHYSICS, 2015, 卷号: 28, 期号: 4, 页码: 415-425
Authors:  Li, Wen-tao;  Chen, Mao-du;  Sun, Zhi-gang
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Quantum Wavepacket  Integral And Differential Cross Section  Reaction Rate Constant  Li Plus Hf/df  Isotope Effect  
Quantum and quasi-classical studies of the He + HeD+ -> HeD+ + He exchange reaction and its isotopic variant 期刊论文
THEORETICAL CHEMISTRY ACCOUNTS, 2014, 卷号: 133, 期号: 10
Authors:  Yao, Cui-Xia
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Time-dependent Wavepacket  Quasi-classical Trajectory  Potential Energy Surface  Integral Cross Section  
Quantum wave-packet and quasiclassical trajectory of reaction S(P-3) plus HD 期刊论文
ACTA PHYSICA SINICA, 2014, 卷号: 63, 期号: 6
Authors:  Duan Zhi-Xin;  Qiu Ming-Hui;  Yao Cui-Xia
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s Plus Hd  Integral Cross Section  Isotope Effect  Reaction Mechanism  
Translational, vibrational, rotational enhancements and alignments of reactions H+ClF (upsilon=0 5, j=0,3,6,9) -> HCl+F and HF+Cl, at E-rel=0.5-20 kcal/mol 期刊论文
CHINESE PHYSICS B, 2013, 卷号: 22, 期号: 10
Authors:  Chao (Wu), Victor Wei-Keh
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Quasi-classical Trajectory Calculation  Integral Cross Section  Alignment  Trv Enhancement  
Theoretical study of the X+YCl (X, Y=H, D) reactions 期刊论文
JOURNAL OF THE CHINESE CHEMICAL SOCIETY, 2003, 卷号: 50, 期号: 3B, 页码: 565-574
Authors:  Yao, L;  Han, KL;  Song, HS;  Zhang, DH
Favorite  |  View/Download:18/0  |  Submit date:2015/11/09
Ab Initio  H/d Plus Dcl/hcl  Collision Energy  Integral Cross Section  Rate Constant