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The effect of carbon vacancy on the properties of ZrC by MEAM potentials 期刊论文
CALPHAD-COMPUTER COUPLING OF PHASE DIAGRAMS AND THERMOCHEMISTRY, 2024, 卷号: 85, 页码: 7
作者:  Ouyang, Yifang;  Xiong, Meiling;  Lin, Kuixin;  Zhou, Yulu;  Chen, Hongmei
收藏  |  浏览/下载:0/0  |  提交时间:2024/05/27
Electronic signal for mechanical failure in two-dimensional g-SiC 期刊论文
SEMICONDUCTOR SCIENCE AND TECHNOLOGY, 2024, 卷号: 39, 期号: 6, 页码: 5
作者:  Li, Jing;  Shi, Tan;  Lu, Chenyang;  Peng Q(彭庆)
收藏  |  浏览/下载:1/0  |  提交时间:2024/05/27
Strain Engineering of Ion-Coordinated Nanochannels in Nanocellulose 期刊论文
NANO LETTERS, 2024, 卷号: 24, 期号: 21, 页码: 6262-6268
作者:  Li, JiaHao;  Hou, YuanZhen;  He, ZeZhou;  Wu HA(吴恒安);  Zhu, YinBo
收藏  |  浏览/下载:0/0  |  提交时间:2024/06/14
An investigation of self-interstitial diffusion in α-zirconium by an on-the-fly machine learning force field 期刊论文
AIP ADVANCES, 2024, 卷号: 14, 期号: 5, 页码: 7
作者:  Shi, Tan;  Liu, Wenlong;  Zhang, Chen;  Lyu, Sixin;  Sun, Zhipeng
收藏  |  浏览/下载:0/0  |  提交时间:2024/06/17
Machine Learning-Accelerated First-Principles Study of Atomic Configuration and Ionic Diffusion in Li10GeP2S12 Solid Electrolyte 期刊论文
MATERIALS, 2024, 卷号: 17, 期号: 8, 页码: 14
作者:  Qi, Changlin;  Zhou, Yuwei;  Yuan XZ(袁晓泽);  Peng Q(彭庆);  Yang, Yong
收藏  |  浏览/下载:1/0  |  提交时间:2024/05/27
Influence of magnetic properties on elemental vacancy migration energy in Fe49.5Mn29.4Co10.1Cr10.1C0.9 high-entropy alloy 期刊论文
AIP ADVANCES, 2024, 卷号: 14, 期号: 4, 页码: 8
作者:  Ibrahim, Shehu Adam;  Shi, Tan;  Su, Zhengxiong;  Liu, Chenguang;  Peng, Qing
收藏  |  浏览/下载:2/0  |  提交时间:2024/06/11
Estimates of chlorine isotope fractionation factors using density functional theory: Applications to ore-forming systems 期刊论文
GEOCHIMICA ET COSMOCHIMICA ACTA, 2024, 卷号: 367, 页码: 1-15
作者:  Zhang, Miao-Miao;  Wei, Hai-Zhen;  Lu, Jian-Jun;  Williams-Jones, A. E.;  Eastoe, C. J.
收藏  |  浏览/下载:2/0  |  提交时间:2024/05/15
Prediction of chemical short-range order in high-/medium-entropy alloys 期刊论文
JOURNAL OF MATERIALS SCIENCE & TECHNOLOGY, 2024, 卷号: 169, 页码: 115-123
作者:  Cao, Pei-Yu;  Wang, Jing;  Jiang, Ping;  Wang, Yun-Jiang;  Yuan, Fu-Ping
收藏  |  浏览/下载:15/0  |  提交时间:2023/10/10
Stable and 7.7 wt% hydrogen storage capacity of Ti decorated Irida-Graphene from first-principles calculations 期刊论文
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY, 2024, 卷号: 50, 页码: 738-748
作者:  Tan, Yongkang;  Tao, Xiaoma;  Ouyang, Yifang;  Peng Q(彭庆)
收藏  |  浏览/下载:4/0  |  提交时间:2024/02/05
Thermoelectric Properties of Mg3(Bi,Sb)2 under Finite Temperatures and Pressures: A First-Principles Study 期刊论文
NANOMATERIALS, 2024, 卷号: 14, 期号: 1, 页码: 17
作者:  Peng Q(彭庆);  Ma, Xinjie;  Yang, Xiaoyu;  Yuan XZ(袁晓泽);  Chen, XiaoJia
收藏  |  浏览/下载:1/0  |  提交时间:2024/02/19


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