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CORC

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Mode Selectivity for a "Central" Barrier Reaction: Eight-Dimensional Quantum Studies of the O(P-3)+CH4 -> OH+CH3 Reaction on an Ab Initio Potential Energy Surface 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 2012, 卷号: 3, 期号: 24, 页码: 3776-3780
作者:  Liu, Rui;  Yang, Minghui;  Czako, Gabor;  Bowman, Joel M.;  Li, Jun
收藏  |  浏览/下载：20/0  |  提交时间：2015/06/25
Correlated High-Frequency Molecular Motions in Neat Liquid Probed with Ultrafast Overtone Two-Dimensional Infrared Spectroscopy 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 2012, 卷号: 3, 期号: 23, 页码: 3665-3670
作者:  Li, Donghai;  Yang, Fan;  Han, Chen;  Zhao, Juan;  Wang, Jianping
收藏  |  浏览/下载：8/0  |  提交时间：2019/04/09
Theoretical Study of the Validity of the Polanyi Rules for the Late-Barrier Cl + CHD3 Reaction 期刊论文
journal of physical chemistry letters, 2012, 卷号: 3, 期号: 23, 页码: 3416-3419
作者:  Zhang, Zhaojun;  Zhou, Yong;  Zhang, Dong H.;  Czako, Gabor;  Bowman, Joel M.
收藏  |  浏览/下载：13/0  |  提交时间：2015/11/09
Correlated High-Frequency Molecular Motions in Neat Liquid Probed with Ultrafast Overtone Two-Dimensional Infrared Spectroscopy 期刊论文
journal of physical chemistry letters, 2012, 卷号: 3, 期号: 23, 页码: 3665-3670
作者:  Li, Donghai;  Yang, Fan;  Han, Chen;  Zhao, Juan;  Wang, Jianping
收藏  |  浏览/下载：12/0  |  提交时间：2015/11/13
What Is the Role of Motif D in the Nucleotide Incorporation Catalyzed by the RNA-dependent RNA Polymerase from Poliovirus? 期刊论文
plos computational biology, 2012, 卷号: 8, 期号: 12
作者:  Shen, Hujun;  Sun, Hui;  Li, Guohui
收藏  |  浏览/下载：20/0  |  提交时间：2015/11/12
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
作者:  Xu, Wenwu;  Li, Wenliang;  Lv, Shuangjiang;  Zhai, Hongsheng;  Duan, Zhixin
收藏  |  浏览/下载：12/0  |  提交时间：2015/11/12
An eight-dimensional quantum mechanical Hamiltonian for X+YCZ(3) system and its applications to H+CH4 reaction 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2012, 卷号: 137, 期号: 17
作者:  Liu, Rui;  Xiong, Hongwei;  Yang, Minghui
收藏  |  浏览/下载：25/0  |  提交时间：2015/06/25
Nucleon-nucleon momentum-correlation function as a probe of the density distribution of valence neutrons in neutron-rich nuclei 期刊论文
PHYSICAL REVIEW C, 2012, 卷号: 86
作者:  Cao, X. G.;  Cai, X. Z.;  Ma, Y. G.;  Fang, D. Q.;  Zhang, G. Q.
收藏  |  浏览/下载：16/0  |  提交时间：2018/07/05
New Implementation of Semi-classical Dynamic Simulation on the Photoisomerization of cis- and trans-Isomers of Free Stilbene 期刊论文
ACTA CHIMICA SINICA, 2012, 卷号: 70, 页码: 1869-1876
作者:  Lei Yibo;  Zhu Chaoyuan;  Wen Zhenyi;  Lin Sheng-Hsien
收藏  |  浏览/下载：16/0  |  提交时间：2018/07/05
Quantum chemical insights into the aggregation induced emission phenomena: A QM/MM study for pyrazine derivatives 期刊论文
JOURNAL OF COMPUTATIONAL CHEMISTRY, 2012, 卷号: 33, 期号: 23, 页码: 1862-1869
作者:  Wu, Qunyan;  Deng, Chunmei;  Peng, Qian;  Niu, Yingli;  Shuai, Zhigang
收藏  |  浏览/下载：11/0  |  提交时间：2019/04/09

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