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Intrinsic defects in gallium sulfide monolayer: a first-principles study 期刊论文
rsc advances, 2015, 卷号: 5, 期号: 63, 页码: 50883-50889
Hui Chen; Yan Li; Le Huang; Jingbo Li
收藏  |  浏览/下载：14/0  |  提交时间：2016/03/29
Charge oscillations and interaction between potassium adatoms on graphene studied by first-principles calculations 期刊论文
physical review b, 2015, 卷号: 91, 期号: 3, 页码: 035415
Xiaojie Liu; Cai-Zhuang Wang; Hai-Qing Lin; Kai Chang; Jian Chen; Kai-Ming Ho
收藏  |  浏览/下载：16/0  |  提交时间：2016/04/08
Indirect-to-direct band gap transition of the ZrS2 monolayer by strain: first-principles calculations 期刊论文
rsc advances, 2014, 卷号: 4, 期号: 15, 页码: 7396-7401
Li, Y; Kang, J; Li, JB
收藏  |  浏览/下载：9/0  |  提交时间：2015/05/11
From the ZnO hollow cage clusters to zno nanoporous phases: A first-principles bottom-up prediction 期刊论文
journal of physical chemistry c, 2013, 卷号: 117, 期号: 34, 页码: 17633-17643
Liu, Zhifeng; Wang, Xinqiang; Cai, Jiangtao; Liu, Gaobin; Zhou, Ping; Wang, Kan; Zhu, Hengjiang
收藏  |  浏览/下载：17/0  |  提交时间：2014/04/28
First-principles study on strontium titanate for visible light photocatalysis 期刊论文
chemical physics letters, 2013, 卷号: 555, 页码: 141-144
Liu, Hongfei; Dong, Huafeng; Meng, Xiuqing; Wu, Fengmin
收藏  |  浏览/下载：10/0  |  提交时间：2013/10/08
Elastic properties of VO2 from first-principles calculation 期刊论文
solid state communications, 2013, 卷号: 167, 页码: 1-4
Dong, Huafeng; Liu, Hongfei
收藏  |  浏览/下载：9/0  |  提交时间：2014/05/08
First-principles study of electronic and magnetic properties of FeC13-based graphite intercalation compounds 期刊论文
physica b: condensed matter, 2013, 卷号: 425, 页码: 72-77
Li, Yan; Yue, Qu
收藏  |  浏览/下载：13/0  |  提交时间：2014/04/28
Elastic properties of tetragonal BiFeO3 from first-principles calculations 期刊论文
applied physics letters, 2013, 卷号: 102, 期号: 18, 页码: 182905
Dong, Huafeng; Chen, Changqing; Wang, Shanying; Duan, Wenhui; Li, Jingbo
收藏  |  浏览/下载：16/0  |  提交时间：2014/04/28
Functionalization of monolayer MoS2 by substitutional doping: A first-principles study 期刊论文
physics letters a, 2013, 卷号: 377, 期号: 19-20, 页码: 1362-1367
Yue, Qu; Chang, Shengli; Qin, Shiqiao; Li, Jingbo
收藏  |  浏览/下载：20/0  |  提交时间：2013/08/27
First-principles study of atomic hydrogen adsorption and initial hydrogenation of Zr(0001) surface 期刊论文
journal of applied physics, 2013, 卷号: 113, 期号: 1, 页码: 013706
Zhang, Peng; Wang, Shuangxi; Zhao, Jian; He, Chaohui; Zhao, Yaolin; Zhang, Ping
收藏  |  浏览/下载：10/0  |  提交时间：2013/10/08

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