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First-principles study of adsorption and migration of alkali and alkaline earth metals (Rb, Cs, and Ba) on graphene 期刊论文
APPLIED SURFACE SCIENCE, 2023, 卷号: 610
作者:  Zhao, Ming;  Li, Xiaochen;  Fang, Shuoyang;  Jiang, Zhizhong;  Yu, Jie
收藏  |  浏览/下载：47/0  |  提交时间：2022/12/23
Metals adsorption  Migration barrier  Work function  Defective graphene  B  O doping  
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：39/0  |  提交时间：2022/12/23
He ion-irradiation  Al-Ga alloy  first-principles  He clusters  
Influence of doubly-hydrogenated oxygen vacancy on the TID effect of MOS devices 期刊论文
FRONTIERS IN MATERIALS, 2022, 卷号: 9
作者:  Lu, Guangbao;  Liu, Jun;  Zheng, Qirong;  Li, Yonggang
收藏  |  浏览/下载：31/0  |  提交时间：2022/12/23
total ionizing dose effect  dynamic modeling  doubly-hydrogenated oxygen vacancy  microscopic mechanism  MOS devices  
Activated sintering effect of Fe element on tungsten via spark plasma sintering 期刊论文
NUCLEAR MATERIALS AND ENERGY, 2022, 卷号: 32
作者:  Chen, Shuai;  Jiang, Zhizhong;  Huang, Jihua;  Yang, Jian;  Ye, Zheng
收藏  |  浏览/下载：48/0  |  提交时间：2022/12/22
Activated sintering  Spark plasma sintering  Tungsten  Solid solution  Mechanical properties  
Leveraging doping and defect engineering to modulate exciton dissociation in graphitic carbon nitride for photocatalytic elimination of marine oil spill 期刊论文
CHEMICAL ENGINEERING JOURNAL, 2022, 卷号: 439
作者:  Xia, Linhong;  Sun, Zhaoli;  Wu, Yuning;  Yu, Xue-Fang;  Cheng, Jianbo;  Zhang, Kaisheng;  Sarina, Sarina;  Zhu, Huai-Yong;  Weerathunga, Helapiyumi;  Zhang, Lixue;  Xia, Jianfei;  Yu, Jianqiang;  Yang, Xiaolong
收藏  |  浏览/下载：37/0  |  提交时间：2022/12/23
Point-Defect Engineering  Graphitic carbon nitride  Oil spill  Dopants  Carbon vacancy  
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：30/0  |  提交时间：2022/12/23
GaN  AlN interface  strain effects  intrinsic point defects  first-principles calculations  diffusion barrier  
High Thermoelectric Performance of CaMg2Bi2 Enabled by Dynamic Doping and Orbital Alignment 期刊论文
ADVANCED FUNCTIONAL MATERIALS, 2022
作者:  Guo, Muchun;  Zhai, Wenya;  Li, Jingyu;  Zhu, Jianbo;  Guo, Fengkai;  Liu, Zihang;  Liu, Ming;  Zhu, Yuke;  Dong, Xingyan;  Zhang, Yongsheng;  Zhang, Qian;  Cai, Wei;  Sui, Jiehe
收藏  |  浏览/下载：70/0  |  提交时间：2022/03/28
dynamic doping  optimal carrier concentration  orbital alignment  thermoelectric CaMg  Bi-2  (2)  
Prediction of vacancy formation energies at tungsten grain boundaries from local structure via machine learning method 期刊论文
JOURNAL OF NUCLEAR MATERIALS, 2022, 卷号: 559
作者:  Wang, Yuxuan;  Li, Xiaolin;  Li, Xiangyan;  Zhang, Yuxiang;  Zhang, Yange;  Xu, Yichun;  Lei, Yawei;  Liu, C. S.;  Wu, Xuebang
收藏  |  浏览/下载：35/0  |  提交时间：2022/12/23
Vacancy formation energy  Machine learning  Tungsten  Symmetry tilt grain boundary  Support vector machine  Cross validation  
Vacancy ordered phases of nonstoichiometric hafnium carbide from evolutionary crystal structure predictions 期刊论文
JOURNAL OF ALLOYS AND COMPOUNDS, 2022, 卷号: 891
作者:  Kostenko, Maxim G.;  Li, Jingyu;  Zeng, Zhi;  Zhang, Yongsheng;  Sharf, Sergey V.;  Gusev, Aleksandr I.;  Lukoyanov, Alexey V.
收藏  |  浏览/下载：125/0  |  提交时间：2021/11/15
Hafnium carbide  Nonstoichiometry  Vacancies  Ordering  Crystal structure prediction  Superstructures  Mechanical properties  First-principles calculations  
Defect evolution in tungsten exposed to helium plasma and deuterium plasmas studied by slow positron beam 期刊论文
NUCLEAR MATERIALS AND ENERGY, 2021, 卷号: 29
作者:  Lyu, Yi-Ming;  Xu, Yu-Ping;  Li, Xiao-Chun;  Shen, Xin;  Wu, Bo-Yu;  Yip, Chi-Shung;  Gao, Xiang;  Lin, Xiao-Dong;  Yang, Zhong-Shi;  Cao, Xing-Zhong;  Zhou, Hai-Shan;  Luo, Guang-Nan
收藏  |  浏览/下载：104/0  |  提交时间：2022/01/10
Tungsten  Helium  Deuterium  Defects  EAST