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CORC

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基于DFT计算的Pt(111)表面氧覆盖度和水合质子模型对氧还原反应路径的影响(英文) 期刊论文
http://electrochem.xmu.edu.cn/CN/abstract/abstract10069.shtml, 2014
欧利辉; 陈胜利; OU Li-hui; CHEN Sheng-li
收藏  |  浏览/下载：5/0  |  提交时间：2014/07/07
Ligand effect on the CuI-catalyzed C-S coupling reaction: A density functional theoretical study 期刊论文
http://dx.doi.org/10.1016/j.comptc.2014.03.019, 2014
Li, Lai-Cai; Sun, Fang-Fang; Pang, Ran; Wu, De-Yin; 吴德印
收藏  |  浏览/下载：6/0  |  提交时间：2015/07/22
Mechanism of Carbon Monoxide Induced N-N Bond Cleavage of Nitrous Oxide Mediated by Molybdenum Complexes: A DFT Study 期刊论文
http://dx.doi.org/10.1021/om400935f, 2014
Xie, Hujun; Yang, Liu; Ye, Xinchen; Cao, Zexing; 杨柳; 曹泽星
收藏  |  浏览/下载：2/0  |  提交时间：2015/07/22
A highly stable and active CaO/Al2O3 base catalyst in the form of calcium aluminate phase for oxidation of cyclohexanone to Ε-caprolactone 期刊论文
http://dx.doi.org/10.1007/s10562-014-1277-6, 2014
Zhu, Lihua; Cao, Maohong; Zhou, Hua; Zhang, Nuowei; Zheng, Jinbao; Li, Yunhua; Chen, Bing; 周华; 郑进保; 李云华; 陈秉辉
收藏  |  浏览/下载：3/0  |  提交时间：2015/07/22
Why does activation of the weaker C=S bond in CS2 by P/N-based frustrated lewis pairs require more energy than that of the C=O bond in CO2? A DFT study 期刊论文
http://dx.doi.org/10.1021/om5009346, 2014
An, Ke; Zhu, Jun; 朱军
收藏  |  浏览/下载：6/0  |  提交时间：2015/07/22
A Highly Stable and Active CaO/Al2O3 Base Catalyst in the Form of Calcium Aluminate Phase for Oxidation of Cyclohexanone to epsilon-Caprolactone 期刊论文
http://dx.doi.org/10.1007/s10562-014-1277-6, 2014
Zhu, Lihua; Cao, Maohong; Zhou, Hua; Zhang, Nuowei; Zheng, Jinbao; Li, Yunhua; Chen, Bing H.; 周华; 李云华; 陈秉辉
收藏  |  浏览/下载：2/0  |  提交时间：2015/07/22
Theoretical study on the interconversion of silabenzenes and their monocyclic non-aromatic isomers via the [1,3]-substituent shift: Interplay of aromaticity and Bent's rule 期刊论文
http://dx.doi.org/10.1016/j.jorganchem.2014.08.018, 2014
Wang, Xuerui; Huang, Ying; An, Ke; Fan, Jinglan; Zhu, Jun; 朱军
收藏  |  浏览/下载：3/0  |  提交时间：2015/07/22
烯丙基类不对称醚异构化反应机理的理论研究 期刊论文
2013
王红; 何桥; 谭凯
收藏  |  浏览/下载：5/0  |  提交时间：2016/05/17
Microkinetics of steam methane reforming on platinum and rhodium metal surfaces 期刊论文
http://dx.doi.org/10.1016/j.jcat.2012.10.010, 2013
Zhu, T. W.; van Grootel, P. W.; Filot, I. A. W.; Sun, S. G.; van Santen, R. A.; Hensen, E. J. M.; 孙世刚
收藏  |  浏览/下载：1/0  |  提交时间：2013/12/12
A Theoretical Study of the Mechanism for Allylic Ether Isomerization 期刊论文
http://dx.doi.org/10.6023/A13680836, 2013
Wang Hong; He Qiao; Tan Kai; 王红; 谭凯
收藏  |  浏览/下载：4/0  |  提交时间：2015/07/22

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