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A permutationally invariant full-dimensional ab initio potential energy surface for the abstraction and exchange channels of the H + CH4 system 期刊论文
journal of chemical physics, 2015, 卷号: 142, 期号: 20, 页码: 204302
作者:  Li, Jun;  Chen, Jun;  Zhao, Zhiqiang;  Xie, Daiqian;  Zhang, Dong H.
收藏  |  浏览/下载：22/0  |  提交时间：2015/11/16
An Intermetallic Au24Ag20 Superatom Nanocluster Stabilized by Labile Ligands 期刊论文
journal of the american chemical society, 2015, 卷号: 137, 期号: 13, 页码: 4324-4327
作者:  Wang, Yu;  Su, Haifeng;  Xu, Chaofa;  Li, Gang;  Gell, Lars
收藏  |  浏览/下载：22/0  |  提交时间：2015/11/16
Effect of Surface Structure on the Photoreactivity of TiO2 期刊论文
journal of physical chemistry c, 2015, 卷号: 119, 期号: 11, 页码: 6121-6127
作者:  Mao, Xinchun;  Wang, Zhiqiang;  Lang, Xiufeng;  Hao, Qunqing;  Wen, Bo
收藏  |  浏览/下载：24/0  |  提交时间：2015/11/16
Enhanced Electron Penetration through an Ultrathin Graphene Layer for Highly Efficient Catalysis of the Hydrogen Evolution Reaction 期刊论文
angewandte chemie-international edition, 2015, 卷号: 54, 期号: 7, 页码: 2100-2104
作者:  Deng, Jiao;  Ren, Pengju;  Deng, Dehui;  Bao, Xinhe
收藏  |  浏览/下载：52/0  |  提交时间：2015/11/16
Triggering the electrocatalytic hydrogen evolution activity of the inert two-dimensional MoS2 surface via single-atom metal doping 期刊论文
energy & environmental science, 2015, 卷号: 8, 期号: 5, 页码: 1594-1601
作者:  Deng, Jiao;  Li, Haobo;  Xiao, Jianping;  Tu, Yunchuan;  Deng, Dehui
收藏  |  浏览/下载：178/0  |  提交时间：2015/11/16
Theoretical Study on the UVR8 Photoreceptor: Sensing Ultraviolet B by Tryptophan and Dissociation of Homodimer 期刊论文
journal of chemical theory and computation, 2014, 卷号: 10, 期号: 8, 页码: 3319
作者:  Li X(李欣);  LungWaChung;  KeijiMorokuma;  Li GH(李国辉)
收藏  |  浏览/下载：19/0  |  提交时间：2015/11/16
Non-adiabatic dynamics of isolated green fluorescent protein chromophore anion 期刊论文
journal of chemical physics, 2014, 卷号: 141, 期号: 23, 页码: 235101
作者:  Zhao, Li;  Zhou, Pan-Wang;  Li, Bin;  Gao, Ai-Hua;  Han, Ke-Li
收藏  |  浏览/下载：16/0  |  提交时间：2015/11/16
Excited state intramolecular proton transfer and substituent effect of 10-hydroxybenzo[h]quinoline: A time-dependent density functional theory study 期刊论文
computational and theoretical chemistry, 2014, 卷号: 1034, 期号: 1, 页码: 80
作者:  ShuoChai;  Shu-LinCong
收藏  |  浏览/下载：16/0  |  提交时间：2015/11/16
Identification of phosphopeptides with unknown cleavage specificity by a de novo sequencing assisted database search strategy 期刊论文
proteomics, 2014, 卷号: 14, 期号: 21-22, 页码: 2410-2416
作者:  Dong, Mingming;  Ye, Mingliang;  Cheng, Kai;  Dong, Jing;  Zhu, Jun
收藏  |  浏览/下载：13/0  |  提交时间：2015/11/16
Bridging the Missing Link between Structure and Fidelity of the RNA-Dependent RNA Polymerase from Poliovirus through Free Energy Simulations 期刊论文
journal of chemical theory and computation, 2014, 卷号: 10, 期号: 11, 页码: 5195-5205
作者:  Shen, Hujun;  Li, Guohui
收藏  |  浏览/下载：25/0  |  提交时间：2015/11/16

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