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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：0/0  |  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：0/0  |  提交时间：2024/06/11
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
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：1/0  |  提交时间：2024/05/15
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：0/0  |  提交时间：2024/02/19
Lattice Thermal Conductivity of Mg3(Bi,Sb)2 Nanocomposites: A First-Principles Study 期刊论文
NANOMATERIALS, 2023, 卷号: 13, 期号: 22, 页码: 12
作者:  Peng, Qing;  Yuan, Xiaoze;  Zhao, Shuai;  Chen, Xiao-Jia
收藏  |  浏览/下载：0/0  |  提交时间：2024/01/08
Assessing Effects of van der Waals Corrections on Elasticity of Mg3Bi2-xSbx in DFT Calculations 期刊论文
MATERIALS, 2023, 卷号: 16, 期号: 19, 页码: 15
作者:  Peng, Qing;  Ma, Xinjie;  Yang, Xiaoyu;  Zhao, Shuai;  Yuan, Xiaoze
收藏  |  浏览/下载：12/0  |  提交时间：2023/11/13
Near-Neighbor Electron Orbital Coupling Effect of Single-Atomic-Layer Au Cluster Intercalated Bilayer 2H-TaS2 for Surface Enhanced Raman Scattering Sensing 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 2023, 卷号: 14
作者:  Weng, Shirui;  Chu, Wenjun;  Zhu, Huaze;  Li, Junxiang;  Dong, Ronglu
收藏  |  浏览/下载：9/0  |  提交时间：2023/11/10

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