Search Results

• Revealing a New Mechanism Feature of F⁻+CH3Cl→Cl⁻+CH3F Reaction by Using Ab Initio Molecular Dynamics

  Yongfang Li, Dun-You Wang

  2018-07-10

  25656 2320 Pages:136-140

• Theoretical Investigation of Mechanism for the Gas-Phase Reaction of OH Radical and Ethane

  Xiao-Ping Hu, Bing-Xing Wang, Ying Gao, Bing Yang

  2011-02-01

  26452 2542 Pages:225-233

• The Mechanism Research for the Surface Plasmon-Catalysed Reaction of the Mercapto Group Substituted Benzoic Acid

  Jiyu Wang, Jing Wang, Caiqing Ma, Meixia Zhang, Yong Ding, Peng Song, Fengcai Ma

  2017-08-01

  28251 2882 Pages:70-74

• Product Angular and Rovibrational State Distributions of the Li + HF(v=0, j=0) → LiF(v', j') + H Reaction

  Xian-Fang Yue, Ming-Chun Jiao

  2016-07-01

  29107 2899 Pages:51-63

• An Investigation of Excited-State Intramolecular Proton Transfer Mechanism of New Chromophore

  Yanling Cui, Pengyu Li, Jing Wang, Peng Song, Lixin Xia

  2018-08-15

  29388 2922 Pages:23-33

• Sulfoxides as Response Elements for Fluorescent Chemosensors: Does It Work?

  Jun-Sheng Chen, Li Zhao, Yang Yang, Tian-Shu Chu

  2018-08-15

  29336 3196 Pages:1-10

• Theoretical Investigation of Photoisomerization Mechanisms of N-Salicilydenemethylfurylamine (SMFA)

  Ai-Hua Gao, Meishan Wang

  2015-06-01

  27913 2558 Pages:83-91

• Effects of the Reagent Rotational Excitation on the Stereodynamics of the Reaction $C(^3P)+CH(X^2\Pi)→C_2+H$

  Jia Liu, Meishan Wang, Aihua Gao, Chuanlu Yang, Xiaolin Sui, Zhenhua Gao

  2015-06-01

  27537 2541 Pages:129-136

• Theoretical Study on the OH with Dimethyl Sulfide Reaction in the Presence of Water

  Wen-Xue Mao, Zheng-Wen Long, Bo Long, Yi-Bo Wang, Chao-Yun Long, Shui-Jie Qin, Shi-Xiong Li

  2012-03-01

  27297 2846 Pages:323-336

• Density Functional Theory Study of the Catalytic Reaction of $N_2O(^1\sum)$ with $CO(^1\sum^+)$ by $Ni^+$

  Dong-Ping Chen, Ke Gai, Chao Kong, Yan-Xia Han, Li-Jie Hou, Bo-Wang Wu

  2014-05-01

  27731 3160 Pages:9-20

• Theoretical Elaboration about Excited State Behaviors and Fluoride Anion Sensor Mechanism for 2-{[2-(2-Hydroxy-Phenyl)-1H-Benzoimidazo-5-yl]-Phenyl-Methylene} Malononitrile

  Jia Li, Xiaodong Li, Shibo Cheng, Peng Song & Jinfeng Zhao

  2018-10-04

  30494 3379 Pages:1-6

• Photoinduced Reaction of Excited Triplet 9,10-Anthraquinone Quenched by Antioxidant Vitamin C

  Sha Chen, Xian-Jun Cao, Yi Luo, Guang-Lai Zhu, Xin-Sheng Xu

  2014-05-01

  28681 2461 Pages:238-246

• Quasiclassical Trajectory Study of Stereodynamics for Exchange Reactions $H'(D')+H(D)S$

  Bo Zhou, Qiang Wei

  2018-08-15

  28377 3025 Pages:52-62

• A Computational Perspective of the Competitive Decomposition and Isomerization of $CH_3OCHFO$ Radical

  Hari Ji Singh, Bhupesh Kumar Mishra

  2013-04-01

  29134 2893 Pages:210-224