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CORC

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Transition metals doped fullerenes: structures – NLO property relationships 期刊论文
Molecular Physics, 2019, 卷号: Vol.117 No.6, 页码: 705-711
作者:  Shuo Liu;  Feng-Wei Gao;  Hong-Liang Xu;  Zhong-Min Su
收藏  |  浏览/下载：8/0  |  提交时间：2019/12/17
Optimizing the Volmer Step by Single-Layer Nickel Hydroxide Nanosheets in Hydrogen Evolution Reaction of Platinum 期刊论文
ACS CATALYSIS, 2015, 卷号: 5, 期号: 6, 页码: 6
作者:  Wang, L;  Lin, C(林冲);  Huang, DK;  Chen, JM;  Jiang, L
收藏  |  浏览/下载：27/0  |  提交时间：2015/12/31
The ensemble effect of formic acid oxidation on platinum-gold electrode studied by first-principles calculations 期刊论文
JOURNAL OF POWER SOURCES, 2015, 卷号: 278, 页码: 203-212
作者:  Zhong, Wenhui;  Qi, Yuanyuan;  Deng, Mingsen
收藏  |  浏览/下载：4/0  |  提交时间：2019/12/17
A DFT/TD-DFT study of thiazolidinedione derivative in dimethylformamide: Cooperative roles of hydrogen bondings, electronic and vibrational spectra 期刊论文
spectrochimica acta part a-molecular and biomolecular spectroscopy, 2014, 卷号: 125, 页码: 131-137
作者:  Wang, Dandan;  Lu, Rui;  Yuan, Minghu;  Fu, Aiping;  Chu, Tianshu
收藏  |  浏览/下载：14/0  |  提交时间：2015/11/13
FACILITATED PHOTOLYSIS OF 9-FLUORENOL IN ALCOHOLS BY EXCITED-STATE HYDROGEN BOND REORGANIZATION 期刊论文
journal of theoretical & computational chemistry, 2012, 卷号: 11, 期号: 3, 页码: 493-504
作者:  Liu, Yu-Hui;  Zhou, Pan-Wang
收藏  |  浏览/下载：15/0  |  提交时间：2013/10/11
The Band Gap Problem: the State of the Art of First-Principles Electronic Band Structure Theory 期刊论文
化学进展, 2012
Hong, Jiang
收藏  |  浏览/下载：6/0  |  提交时间：2015/11/13
CO2在Cu表面还原成碳氢化合物的DFT计算研究 期刊论文
http://electrochem.xmu.edu.cn/CN/abstract/abstract9792.shtml, 2011
欧利辉; 陈胜利; Ou Li-Hui; CHEN Sheng-Li
收藏  |  浏览/下载：2/0  |  提交时间：2013/11/18
Synthesis, structures, photoluminescence, and theoretical investigations on two new Zn(II)/Mn(II) complexes with pyridine-2-amidoxine and carboxylate ligands 期刊论文
STRUCTURAL CHEMISTRY, 2011, 卷号: 22, 页码: 1113-1118
作者:  Ran, Jingwen;  Tong, Yi-Ping
收藏  |  浏览/下载：5/0  |  提交时间：2019/12/18
Adsorption of CO on the O_2 pre-adsorbed LaFeO_3 (0 1 0) surface: A density functional theory study 期刊论文
Current applied physics: the official journal of the Korean Physical Society, 2011, 卷号: 11, 期号: 6, 页码: 1278-1281
作者:  Sun, L.;  Hu, J.;  Zhang, L.;  Gao, F.;  Zhang, Y.
收藏  |  浏览/下载：2/0  |  提交时间：2019/12/23
First-Principles Investigation Density of States for LiNi1-xCoxO2 with x=0, 1/3, 2/3 and 1 会议论文
International Conference on Chemical Engineering and Advanced Materials, MAY 28-30, 2011
作者:  Gu, Yijie;  Chen, Yunbo;  Liu, Hongquan;  Wu, Huikang;  Huang, Xiaowen
收藏  |  浏览/下载：4/0  |  提交时间：2019/12/31

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