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Charge transport in organic donor-acceptor mixed-stack crystals: the role of nonlocal electron-phonon couplings 期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2017, 卷号: 19, 期号: 6, 页码: 4418-4425
作者:  Zhu, Lingyun;  Geng, Hua;  Yi, Yuanping;  Wei, Zhixiang
收藏  |  浏览/下载:26/0  |  提交时间:2018/01/12
Electron-phonon couplings and carrier mobility in graphynes sheet calculated using the Wannier-interpolation approach 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2014, 卷号: 141, 期号: 3
作者:  Xi, Jinyang;  Wang, Dong;  Yi, Yuanping;  Shuai, Zhigang
收藏  |  浏览/下载:10/0  |  提交时间:2019/04/09
Energy relaxation and separation of a hot electron-hole pair in organic aggregates from a time-dependent wavepacket diffusion method 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2014, 卷号: 140, 期号: 21
作者:  Han, Lu;  Zhong, Xinxin;  Liang, WanZhen;  Zhao, Yi
收藏  |  浏览/下载:16/0  |  提交时间:2019/04/09
From charge transport parameters to charge mobility in organic semiconductors through multiscale simulation 期刊论文
CHEMICAL SOCIETY REVIEWS, 2014, 卷号: 43, 期号: 8, 页码: 2662-2679
作者:  Shuai, Zhigang;  Geng, Hua;  Xu, Wei;  Liao, Yi;  Andre, Jean-Marie
收藏  |  浏览/下载:14/0  |  提交时间:2019/04/09
Effects of pressure and temperature on the carrier transports in organic crystal: A first-principles study 期刊论文
JOURNAL OF CHEMICAL PHYSICS, 2008, 卷号: 128, 期号: 19
作者:  Wang, L. J.;  Li, Q. K.;  Shuai, Z.
收藏  |  浏览/下载:8/0  |  提交时间:2019/04/09
First-principle band structure calculations of tris(8-hydroxyquinolinato)aluminum 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY B, 2006, 卷号: 110, 期号: 7, 页码: 3180-3184
作者:  Yang, YT;  Geng, H;  Yin, SW;  Shuai, ZG;  Peng, JB
收藏  |  浏览/下载:10/0  |  提交时间:2019/04/09


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