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Full-dimensional quantum mechanical calculations of the reaction probability of the H + CH4 reaction based on a mixed Jacobi and Radau description

机译：基于混合雅非和拉伸描述的H + CH4反应的全尺寸量子力学计算

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Zhaojun Zhang; Fabien Gatti; Dong H. Zhang;
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1. Full-dimensional quantum mechanical calculations of the reaction probability of the H + CH4 reaction based on a mixed Jacobi and Radau description [J] . Zhang Zhaojun, Gatti Fabien, Zhang Dong H. The Journal of Chemical Physics . 2020,第20期

机译：基于混合雅非和拉伸描述的H + CH4反应的全尺寸量子力学计算
2. Full dimensional quantum mechanical calculations of the reaction probability of the H + NH3 collision based on a mixed Jacobi and Radau description [J] . Zhang Zhaojun, Gatti Fabien, Zhang Dong H. The Journal of Chemical Physics . 2019,第20期

机译：全尺寸量子力学计算H + NH3碰撞的反应概率基于混合雅非和拉伸描述
3. Quantum mechanical calculation of the OH+HCl - H2O+Cl reaction rate: Full-dimensional accurate, centrifugal sudden, and J-shifting results [J] . Huarte-Larranaga F., Manthe U. The Journal of Chemical Physics . 2003,第18期

机译：OH + HCl-> H2O + Cl反应速率的量子力学计算：全尺寸精确，离心突变和J位移结果
4. ACID-BASE AND CATALYTIC PROPERTIES OF MIXED OXIDES IN SELECTIVE HETEROGENEOUS OXIDATION REACTIONS: DESCRIPTION OF ACTIVE SITES [C] . Jacques C. Vedrine ACS National Meeting Exhibition . 2015

机译：选择性异质氧化反应中混合氧化物的酸碱和催化性质：活性位点的描述
5. Use of Quantum Mechanical Calculations for Mechanistic Determination and Structural Assignment in Organic Reactions [D] . Saunders, Carla Maria. 2019

机译：量子力学计算对机械测定和有机反应结构分配的使用
6. Fundamental Reaction Pathway for Peptide Metabolism by Proteasome: Insights from First-principles Quantum Mechanical/Molecular Mechanical Free Energy Calculations [O] . Donghui Wei, Lei Fang, Mingsheng Tang, -1

机译：蛋白酶体肽代谢的基本反应途径：第一性原理量子力学/分子机械自由能计算的见解
7. Full dimensional quantum mechanical calculations of the reaction probability of the H + NH3 collision based on a mixed Jacobi and Radau description [O] . Zhaojun Zhang, Fabien Gatti, Dong H. Zhang 2019

机译：全尺寸量子力学计算H + NH3碰撞的反应概率基于混合雅非和拉伸描述

Full-dimensional quantum mechanical calculations of the reaction probability of the H + CH4 reaction based on a mixed Jacobi and Radau description

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