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CORC

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方铅矿、黄铜矿和黄铁矿表面氧化与可浮性研究 学位论文
: 中国科学院大学, 2019
作者:  牛晓鹏
收藏  |  浏览/下载：8/0  |  提交时间：2020/06/17
Surface-enhanced Raman scattering of dipolar molecules by the graphene Fermi surface modulation with different dipole moments 期刊论文
APPLIED SURFACE SCIENCE, 2017, 卷号: 425, 页码: 654-662
作者:  Zhang, Mingjia;  Leng, Yandan;  Huang, Jing;  Yu, Jiaojiao;  Lan, Zhenggang
收藏  |  浏览/下载：31/0  |  提交时间：2017/12/04
Geometries and Electronic States of Divacancy Defect in Finite-Size Hexagonal Graphene Flakes 期刊论文
JOURNAL OF CHEMISTRY, 2017
作者:  Liu, Lili;  Chen, Shimou
收藏  |  浏览/下载：11/0  |  提交时间：2017/04/07
Femtosecond charge and molecular dynamics of I-containing organic molecules induced by intense X-ray free-electron laser pulses 期刊论文
FARADAY DISCUSSIONS, 2016, 卷号: 194, 页码: 537-562
作者:  Nagaya, K;  Motomura, K;  Kukk, E;  Takahashi, Y;  Yamazaki, K
收藏  |  浏览/下载：20/0  |  提交时间：2017/03/02
Quantum Chemical Molecular Dynamics Studies of Bilayer Graphene Growth on a Ni(111) Surface 期刊论文
journal of physical chemistry c, 2015, 卷号: 119, 期号: 22, 页码: 12643-12650
作者:  Jiao,Menggai;  Li,Kai;  Wang,Ying;  Wu,Zhijian
收藏  |  浏览/下载：23/0  |  提交时间：2016/05/12
Crystalline Ni3C as both carbon source and catalyst for graphene nucleation: a QM/MD study 期刊论文
scientific reports, 2015, 卷号: 5, 页码: 12091
作者:  Jiao,Menggai;  Li,Kai;  Guan,Wei;  Wang,Ying;  Wu,Zhijian
收藏  |  浏览/下载：13/0  |  提交时间：2016/05/06
Nonadiabatic Molecular Dynamics Modeling of the Intrachain Charge Transport in Conjugated Diketopyrrolo-pyrrole Polymers 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY C, 2014, 卷号: 118, 期号: 13, 页码: 6631-6640
作者:  Gao, Xing;  Geng, Hua;  Peng, Qian;  Ren, Jiajun;  Yi, Yuanping
收藏  |  浏览/下载：9/0  |  提交时间：2019/04/09
Excited-state properties of a blue luminescent covalent organic framework by the time-dependent density-functional tight-binding method 期刊论文
computational and theoretical chemistry, 2014, 卷号: 1030, 期号: 1, 页码: 17-24
作者:  Fan, Guo-Hong;  Li, Xing;  Liu, Jian-Yong;  He, Guo-Zhong
收藏  |  浏览/下载：31/0  |  提交时间：2015/11/16
Time-dependent Density Functional-based Tight-bind Method Efficiently Implemented with OpenMP Parallel and GPU Acceleration 期刊论文
chinese journal of chemical physics, 2013, 卷号: 26, 期号: 6, 页码: 635-645
作者:  Fan, Guo-hong;  Han, Ke-li;  He, Guo-zhong
收藏  |  浏览/下载：53/0  |  提交时间：2015/11/09
Nonadiabatic dynamics study of bridged-azobenzene by the time-dependent density functional tight-binding method 期刊论文
computational and theoretical chemistry, 2013, 卷号: 1023, 页码: 10-18
作者:  Fan, Guohong;  Liu, Jianyong;  He, Guozhong
收藏  |  浏览/下载：15/0  |  提交时间：2014/09/11

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