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Tuning the electronic and magnetic properties of borophene by 3d transition-metal atom adsorption 期刊论文
PHYSICS LETTERS A, 2016, 卷号: 380, 期号: 46, 页码: 3928-3931
作者:  Li, J. Y.;  Lv, H. Y.;  Lu, W. J.;  Shao, D. F.;  Xiao, R. C.
收藏  |  浏览/下载：15/0  |  提交时间：2017/11/21
Uncovering the Intramolecular Emission and Tuning the Nonlinear Optical Properties of Organic Materials by Cocrystallization 期刊论文
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 2016, 卷号: 55, 期号: 45, 页码: 14023-14027
作者:  Zhu, Weigang;  Zhu, Lingyun;  Sun, Lingjie;  Zhen, Yonggang;  Dong, Huanli
收藏  |  浏览/下载：26/0  |  提交时间：2016/12/29
Unveiling self-sensitized photodegradation pathways by DPT calculations: A case of sunscreen p-aminobenzoic acid 期刊论文
CHEMOSPHERE, 2016, 卷号: 163, 页码: 227-233
作者:  Zhang, Siyu;  Chen, Jingwen;  Zhao, Qing;  Xie, Qing;  Wei, Xiaoxuan
收藏  |  浏览/下载：16/0  |  提交时间：2016/12/02
Density functional theory study of alpha-cyanoacrylic acid adsorbed on rutile TiO2(110) surface 期刊论文
COMPUTATIONAL AND THEORETICAL CHEMISTRY, 2016, 卷号: 1095, 页码: 125-133
作者:  Zhang, Yang;  Zhang, Cai-Rong;  Wang, Wei;  Gong, Ji-Jun;  Liu, Zi-Jiang
收藏  |  浏览/下载：3/0  |  提交时间：2019/11/15
The Effects of Heteroatoms Si and S on Tuning the Optical Properties of Rhodamine- and Fluorescein-Based Fluorescence Probes: A Theoretical Analysis 期刊论文
CHEMPHYSCHEM, 2016, 卷号: 17, 期号: 19, 页码: 3139-3145
作者:  Ning, Cai;  Zhou, Panwang;  Alsaedi, Ahmed;  Han, Keli
收藏  |  浏览/下载：8/0  |  提交时间：2019/06/20
An Expedient Method for Regioselective Methylation of Catechol Coumarins 期刊论文
CHEMICAL RESEARCH IN CHINESE UNIVERSITIES, 2016, 卷号: 32, 期号: 5, 页码: 786-791
作者:  Ge Guangbo;  Lu Junxia;  Wang Ping;  Hou Jie;  Zou Liwei
收藏  |  浏览/下载：15/0  |  提交时间：2019/06/20
Changing the chirality of single-wall carbon nanotubes during epitaxial growth: A density functional theory study 期刊论文
NEW CARBON MATERIALS, 2016, 卷号: 31, 期号: 5, 页码: 525-531
Shen, W; Li, F; Liu, C; Yin, LC
收藏  |  浏览/下载：30/0  |  提交时间：2016/12/28
Strained monolayer germanene with 1?×?1 lattice on sb(111) 期刊论文
2d materials, 2016, 卷号: 3, 期号: 4
作者:  Gou,Jian;  Zhong,Qing;  Sheng,Shaoxiang;  Li,Wenbin;  Cheng,Peng
收藏  |  浏览/下载：33/0  |  提交时间：2019/05/09
Determine the Role of Alkyl Chains and Hydrogen Bonds in the Assembling Process of Fused Thiophene Indacene Derivatives by Scanning Tunneling Microscopy and Theoretical Calculation 期刊论文
Journal of Physical Chemistry C, 2016, 卷号: 120, 期号: 38, 页码: 21699-21703
作者:  Liu, Zhi-Fei;  Xu, Huan;  Duan, Rui-Hong;  Yang, Zhi-Yong;  Zhang, Hao-Li
收藏  |  浏览/下载：42/0  |  提交时间：2017/01/12
First-principle study of O vacancy on LaNiO3 (001) surface 期刊论文
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY, 2016, 卷号: 41, 期号: 35, 页码: 15756-15763
作者:  Pan, Chang-Chang;  Chen, Yu-Hong;  Wu, Na;  Zhang, Mei-Ling;  Yuan, Li-Hua
收藏  |  浏览/下载：6/0  |  提交时间：2019/11/15

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