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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
Single- and double-charge transfer in slow He2+-He collisions 期刊论文
JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS, 2012, 卷号: 45
作者:  Liu, C. H.;  Wang, J. G.;  Janev, R. K.
收藏  |  浏览/下载：17/0  |  提交时间：2018/07/05
Low-lying electronic states and their nonradiative deactivation of thieno[3,4-b]pyrazine: An ab initio study 期刊论文
http://dx.doi.org/10.1063/1.4770229, 2012
Guo, Xugeng; Cao, Zexing; 曹泽星
收藏  |  浏览/下载：9/0  |  提交时间：2013/12/12
Critical appraisal of excited state nonadiabatic dynamics simulations of 9H-adenine 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2012, 卷号: 137, 期号: 22
作者:  Barbatti, Mario;  Lan, Zhenggang;  Crespo-Otero, Rachel;  Szymczak, Jaroslaw J.;  Lischka, Hans
收藏  |  浏览/下载：17/0  |  提交时间：2015/11/02
Imaging the O(D-1)+CD4 -> OD+CD3 reaction dynamics: Probing vibrationally and rotationally excited CD3 products 期刊论文
journal of chemical physics, 2012, 卷号: 137, 期号: 22
作者:  Shuai, Quan;  Pan, Huilin;  Yang, Jiayue;  Zhang, Dong;  Jiang, Bo
收藏  |  浏览/下载：11/0  |  提交时间：2015/11/09
Ab initio Calculations of Deep-Level Carrier Nonradiative Recombination Rates in Bulk Semiconductors 期刊论文
Physical Review Letters, 2012, 卷号: 109, 期号: 24
作者:  Lin Shi(石林)
收藏  |  浏览/下载：14/0  |  提交时间：2013/01/22
Quantum instanton calculation of rate constant for CH4+OH -> CH3+H2O reaction: Torsional anharmonicity and kinetic isotope effect 期刊论文
http://dx.doi.org/10.1063/1.4768874, 2012
Wang, Wenji; Zhao, Yi; 赵仪
收藏  |  浏览/下载：2/0  |  提交时间：2015/07/22
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：9/0  |  提交时间：2019/04/09
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
A Frontier Molecular Orbital Theory Approach to Understanding the Mayr Equation and to Quantifying Nucleophilicity and Electrophilicity by Using HOMO and LUMO Energies 期刊论文
ASIAN JOURNAL OF ORGANIC CHEMISTRY, 2012, 卷号: 1, 期号: 4, 页码: 336-345
作者:  Zhuo, Lian-Gang;  Liao, Wei;  Yu, Zhi-Xiang
收藏  |  浏览/下载：21/0  |  提交时间：2019/06/20

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