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First—principles study of NO reduction by CO on transition metal atoms—\\doped CeO2(111) 期刊论文
Chinese Journal of Catalysis催化学报, 2015, 卷号: 35, 期号: 12, 页码: 1937
作者:  WuchenDing;  Li WX(李微雪)
收藏  |  浏览/下载:6/0  |  提交时间:2015/11/16
A First-Principles Study of Carbon–Oxygen Bond Scission in Multiatomic Molecules on Flat and Stepped Metal Surfaces 期刊论文
ChemCatChem, 2014, 卷号: 6, 期号: 1, 页码: 1755
作者:  Yong-HuiZhao;  Liu JX(刘进勋);  Su HY(苏海燕);  KejuSun;  Li WX(李微雪)
收藏  |  浏览/下载:14/0  |  提交时间:2015/11/16
Wavelength dependence of Autler-Townes splitting in a four-level ladder molecular system 期刊论文
epl, 2014, 卷号: 108, 期号: 5, 页码: 53002
作者:  Guo, Wei;  Lu, Xingqiang;  Wang, Xinlin;  Yao, Hongbin
收藏  |  浏览/下载:13/0  |  提交时间:2015/11/16
Tuning the energy band-gap of crystalline gallium oxide to enhance photocatalytic water splitting: mixed-phase junctions 期刊论文
journal of materials chemistry a, 2014, 卷号: 2, 期号: 40, 页码: 17005-17014
作者:  Ju, Ming-Gang;  Wang, Xiang;  Liang, WanZhen;  Zhao, Yi;  Li, Can
收藏  |  浏览/下载:15/0  |  提交时间:2015/11/16
First-Principles Study of Methanol Oxidation into Methyl Formate on Rutile TiO2(110) 期刊论文
journal of physical chemistry c, 2014, 卷号: 118, 期号: 34, 页码: 19859-19868
作者:  Lang, Xiufeng;  Wen, Bo;  Zhou, Chuanyao;  Ren, Zefeng;  Liu, Li-Min
收藏  |  浏览/下载:21/0  |  提交时间:2015/11/16
Single Pd Atom Embedded in CeO2(111) for NO Reduction with CO: A First-Principles Study 期刊论文
journal of physical chemistry c, 2014, 卷号: 118, 期号: 23, 页码: 12216-12223
作者:  Ding, Wu-Chen;  Gu, Xiang-Kui;  Su, Hai-Yan;  Li, Wei-Xue
收藏  |  浏览/下载:21/0  |  提交时间:2015/11/16
New insights on gold catalysis and its stability from first-principles 会议论文
the physics, chemistry, and biology of gold: from nanoparticles to clusters, 东京, 41773
李微雪
收藏  |  浏览/下载:15/0  |  提交时间:2014/09/11
Reaction pathways and free energy profiles for cholinesterase-catalyzed hydrolysis of 6-monoacetylmorphine 期刊论文
organic & biomolecular chemistry, 2014, 卷号: 12, 期号: 14, 页码: 2214-2227
作者:  Qiao, Yan;  Han, Keli;  Zhan, Chang-Guo
收藏  |  浏览/下载:15/0  |  提交时间:2015/11/16
Crystallographic Dependence of CO Activation on Cobalt Catalysts: HCP versus FCC 期刊论文
journal of the american chemical society, 2013, 卷号: 135, 期号: 44, 页码: 16284-16287
作者:  Liu, Jin-Xun;  Su, Hai-Yan;  Sun, Da-Peng;  Zhang, Bing-Yan;  Li, Wei-Xue
收藏  |  浏览/下载:32/0  |  提交时间:2014/09/11
Probing Quantum Dynamics of Elementary Chemical Reactions via Accurate Potential Energy Surfaces 期刊论文
zeitschrift fur physikalische chemie-international journal of research in physical chemistry & chemical physics, 2013, 卷号: 227, 期号: 9-11, 页码: 1247-1265
作者:  Yang, Xueming;  Zhang, Dong Hui
收藏  |  浏览/下载:19/0  |  提交时间:2014/09/11


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