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CORC

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Investigation of the intramolecular hydrogen bonding interactions and excited state proton transfer mechanism for both Br-BTN and CN-BTN systems 期刊论文
RSC ADVANCES, 2019, 卷号: 9, 期号: 40, 页码: 23004-23011
作者:  Yang, Dapeng;  Zhang, Qiaoli;  Song, Xiaoyan;  Zhang, Tianjie
收藏  |  浏览/下载：56/0  |  提交时间：2019/12/02
A time-dependent density functional theory study on the excited state behavior of a novel T-2(OH)B molecule 期刊论文
JOURNAL OF THE CHINESE CHEMICAL SOCIETY, 2019, 页码: 8
作者:  Jia, Min;  Song, Xiaoyan;  Yang, Xiaohui;  Yang, Dapeng
收藏  |  浏览/下载：57/0  |  提交时间：2019/12/02
Dynamical resonances in F + H-2/HD reaction scattering 期刊论文
THEORETICAL CHEMISTRY ACCOUNTS, 2018, 卷号: 137, 期号: 2
作者:  Li, Xueming;  Sun, Zhigang
收藏  |  浏览/下载：10/0  |  提交时间：2019/06/20
Ionization spectroscopies and theoretical calculations of cis and trans 3-fluoro-N-methylaniline-Ar-n(n=1,2) van der Waals clusters: Structures and binding energies 期刊论文
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2017, 卷号: 183, 页码: 177-186
作者:  Du, Yikui;  Zhang, Lijuan;  Li, Dazhi;  Cheng, Min;  Zhu, Qihe
收藏  |  浏览/下载：24/0  |  提交时间：2017/10/29
A Theoretical Investigation on Intramolecular Hydrogen Bond: The ESIPT Mechanism of dmahf Sensor 期刊论文
JOURNAL OF CLUSTER SCIENCE, 2017, 卷号: 28, 页码: 937-947
作者:  Yang, Dapeng;  Zheng, Rui;  Wang, Yusheng;  Lv, Jian
收藏  |  浏览/下载：16/0  |  提交时间：2017/10/29
State-to-state mode selectivity in the HD plus OH reaction: Perspectives from two product channels 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2016, 卷号: 144, 期号: 21
作者:  Zhao, Bin;  Sun, Zhigang;  Guo, Hua
收藏  |  浏览/下载：12/0  |  提交时间：2019/06/20
Infrared photodissociation spectroscopy of M(N-2)(n)(+) (M = Y, La, Ce; n=7-8) in the gas phase 期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2016, 卷号: 18, 期号: 6, 页码: 4444-4450
作者:  Xie, Hua;  Shi, Lei;  Xing, Xiaopeng;  Tang, Zichao
收藏  |  浏览/下载：17/0  |  提交时间：2019/06/20
Communication: State-to-state dynamics of the Cl + H2O → HCl + OH reaction: Energy flow into reaction coordinate and transition-state control of product energy disposal 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2015, 卷号: 142, 期号: 24, 页码: 2411011
作者:  Zhao B(赵斌);  Sun ZG(孙志刚);  Guo H(郭华)
收藏  |  浏览/下载：10/0  |  提交时间：2016/11/24
State-to-State Mode Specificity: Energy Sequestration and Flow Gated by Transition State 期刊论文
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2015, 卷号: 137, 期号: 50, 页码: 15964-15970
作者:  Zhao, Bin;  Sun, Zhigang;  Guo, Hua
收藏  |  浏览/下载：13/0  |  提交时间：2019/06/20
Crystal structure refinement of the electron-transfer-active potassium manganese hexacyanoferrates and isomorphous potassium manganese hexacyanocobaltates 期刊论文
journal of solid state chemistry, 2015, 卷号: 227, 页码: 35-44
作者:  Rykov, Alexandre I.;  Li, Xuning;  Wang, Junhu
收藏  |  浏览/下载：15/0  |  提交时间：2015/11/17

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