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First-principles study of He retention and clustering in Al-Ga alloy 期刊论文
INTERNATIONAL JOURNAL OF MODERN PHYSICS C, 2022
作者:  Wei, Liuming;  Li, Jingyu;  Li, Yonggang;  Ye, Xiaoqiu;  Niu, Caoping;  Zheng, Qirong;  Cheng, Fan;  Zhang, Chuanguo;  Zeng, Zhi
收藏  |  浏览/下载：35/0  |  提交时间：2022/12/23
He ion-irradiation  Al-Ga alloy  first-principles  He clusters  
Individual cascade annealing in BCC tungsten: effects of size and spatial distributions of defects 期刊论文
RSC ADVANCES, 2022, 卷号: 12
作者:  Wei, Liuming;  Zhang, Chuanguo;  Zheng, Qirong;  Zeng, Zhi;  Li, Yonggang
收藏  |  浏览/下载：37/0  |  提交时间：2022/12/23
Strain effects on the behavior of intrinsic point defects within the GaN/AlN interface 期刊论文
INTERNATIONAL JOURNAL OF MODERN PHYSICS C, 2022
作者:  Yang, Yuming;  Zhang, Xuemei;  Liu, Jun;  Zhang, Chuanguo;  Li, Yonggang;  Zeng, Zhi;  Zhang, Yongsheng
收藏  |  浏览/下载：28/0  |  提交时间：2022/12/23
GaN  AlN interface  strain effects  intrinsic point defects  first-principles calculations  diffusion barrier  
Polymerization of Nitrogen in Nitrogen-Fluorine Compounds under Pressure 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 2021, 卷号: 12
作者:  Zhang, Jie;  Niu, Caoping;  Zhang, Hanxing;  Zhao, Jing;  Wang, Xianlong;  Zeng, Zhi
收藏  |  浏览/下载：29/0  |  提交时间：2021/08/30
One-electron reduction induced spin transition in Fe(ii) spin crossover molecules and the effect of the ligand dagger 期刊论文
JOURNAL OF MATERIALS CHEMISTRY C, 2021
作者:  Hao, Hua;  Jia, Ting;  Zheng, Xiaohong;  Liu, Peng;  Zeng, Zhi
收藏  |  浏览/下载：37/0  |  提交时间：2021/04/26
The stability of graphene-based Mobius strip with vacancy and at high-temperature 期刊论文
INTERNATIONAL JOURNAL OF MODERN PHYSICS B, 2018, 卷号: 32, 期号: 31, 页码: 9
作者:  Yang, Kaishuai;  Zhang, Chuanguo;  Zheng, Xiaohong;  Wang, Xianlong;  Zeng, Zhi
浏览  |  Adobe PDF(1164Kb)  |  收藏  |  浏览/下载：64/33  |  提交时间：2020/03/31
Graphene-based Mobius strip  mono-vacancy defect  melting temperature  
The polymerization of nitrogen in Li2N2 at high pressures 期刊论文
SCIENTIFIC REPORTS, 2018, 卷号: 8, 页码: 6
作者:  Zhang, Jie;  Wang, Xianlong;  Yang, Kaishuai;  Cheng, Ya;  Zeng, Zhi
收藏  |  浏览/下载：26/0  |  提交时间：2019/12/10
The suppression of Cu-related charge localized defects in Cu2ZnSnS4 thin film solar cells 期刊论文
SOLAR ENERGY MATERIALS AND SOLAR CELLS, 2018, 卷号: 180, 期号: 无, 页码: 118-122
作者:  Zhang, Xiaoli;  Han, Miaomiao;  Zheng, Xiaohong;  Zeng, Zhi
浏览  |  Adobe PDF(793Kb)  |  收藏  |  浏览/下载：93/54  |  提交时间：2019/06/10
Defect  Charge localization  Formation energy  Charge transition energy  CZTS  
An investigation of Na-related defects in Cu2ZnSnSe4 期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2017, 卷号: 19, 期号: 27, 页码: 17799-17804
作者:  Han, Miaomiao;  Zhang, Xiaoli;  Zeng, Zhi
收藏  |  浏览/下载：37/0  |  提交时间：2018/07/27
Orientation-dependent behaviors of H dissolution and diffusion near W surfaces: A first-principles study 期刊论文
INTERNATIONAL JOURNAL OF MODERN PHYSICS C, 2017, 卷号: 28, 期号: 7
作者:  Pan, Guyue;  Zhang, Yongsheng;  Li, Yonggang;  Zhang, Chuanguo;  Zhao, Zhe;  Zeng, Zhi
收藏  |  浏览/下载：44/0  |  提交时间：2018/08/16
Tungsten  Surface Orientation  Dissolution  Diffusion  First-principles