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Potential Energy Surfaces for the First Two Lowest-Lying Electronic States of the LiH2+ System, and Dynamics of the H+ + LiH reversible arrow H-2(+) + Li + Reactions 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY A, 2016, 卷号: 120, 期号: 15, 页码: 2459-2470
Authors:  He, Xiaohu;  Lv, Shuangjiang;  Hayat, Tasawar;  Han, Keli
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Theoretical study of the effect of ligand topology on Fe(IV)O and Ru(IV)O complex reactivities 期刊论文
INORGANICA CHIMICA ACTA, 2016, 卷号: 443, 页码: 235-242
Authors:  Tang, Zhe;  Wang, Yi;  Cui, Xiaolei;  Yang, Ying;  Tian, Jing;  Fei, Xu;  Lv, Shuangjiang
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Non-heme  Density Functional Theory Calculation  Hydrogen Abstraction  Ligand Topology Effect  
Quasiclassical dynamics for the H+HS abstraction and exchange reactions on the 3A and the 3A states 期刊论文
Journal of Chemical Physics, 2013, 卷号: 139, 期号: 9, 页码: 094307
Authors:  Duan ZX(段志欣);  Li WL(李文亮);  Xu WW(许文武);  Lv SJ(吕双江)
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Coriolis Coupling Effects in O+(S-4) + H-2(X-1 Sigma(+)(g)) -> OH+(X-3 Sigma(-)) + H(S-2) Reaction and Its Isotopic Variants: Exact Time-Dependent Quantum Scattering Study 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY A, 2012, 卷号: 116, 期号: 45, 页码: 10882-10888
Authors:  Xu, Wenwu;  Li, Wenliang;  Lv, Shuangjiang;  Zhai, Hongsheng;  Duan, Zhixin;  Zhang, Peiyu
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Exact quantum scattering study of the H + HS reaction on a new ab initio potential energy surface H2S(3A) 期刊论文
Journal of Chemical Physics, 2012, 卷号: 136, 页码: 943081
Authors:  Lv SJ(吕双江);  Zhang PY(张佩宇);  Han KL(韩克利);  He GZ(何国钟)
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Exact Quantum-Scattering Study of the D(2𝑆)+DS(2Π) Reaction * 期刊论文
Chinese Physics Letters(中国期刊), 2012, 卷号: 29, 期号: 7, 页码: 734011
Authors:  Lv SJ(吕双江);  Zhang PY(张佩宇);  He GZ(何国钟)
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Coriolis Coupling Effects in O+(4S) + H2(X1Σg Reaction and Its Isotopic Variants: Exact Time-Dependent Quantum Scattering Study 期刊论文
Journal of Physical Chemistry A, 2012, 卷号: 116, 页码: 10882
Authors:  Xu WW(许文武);  Li WL(李文亮);  Lv SJ(吕双江);  Zhai HS(翟红生);  Duan ZX(段志欣);  Zhang PY(张佩宇)
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Time-dependent Wave Packet Quantum Scattering Study of Reaction S(3P)+H2-HS+H on a New ab initio Potential Energy Surface 3A 期刊论文
Chinese Journal of Chemical Physics(中国期刊), 2012, 卷号: 25, 期号: 3, 页码: 291
Authors:  Lv SJ(吕双江);  Zhang PY(张佩宇);  He GZ(何国钟)
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Quantumwavepacketdynamicsstudy of the S(3P) + H2 reaction on the lowest SH2(13A′′) state 期刊论文
Computational and Theoretical Chemistry, 2012, 卷号: 997, 页码: 83
Authors:  吕双江;  张佩宇;  赵美玉;  何国钟
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A new ab initio potential energy surface of NeH2+ system and time-dependent quantum dynamics study 会议论文
, 中国, 2009-06-01
Authors:  Lv SJ(吕双江);  Zhang PY(张佩宇);  Han KL(韩克利);  He GZ(何国钟)
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