中国科学院机构知识库网格系统: 检索

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	Active-learning search for unitcell structures: A case study on Mg3Bi2-xSbx 期刊论文 OAI收割 COMPUTATIONAL MATERIALS SCIENCE, 2023, 卷号: 226, 页码: 112260 作者: Peng Q(彭庆); Yuan XZ(袁晓泽); Zhao S(赵帅); Zhou, Yuwei; Wen, Xiaodong \| 收藏 \| 浏览/下载：15/0 \| 提交时间：2023/07/17 Crystal structure prediction First -principles calculations Mg-Bi-Sb alloy Active learning strategy Unitcell modeling
	Phase decomposition and strengthening in HfNbTaTiZr high entropy alloy from first-principles calculations 期刊论文 OAI收割 ACTA MATERIALIA, 2022, 卷号: 225, 页码: 16 作者: Chen, Shu-Ming; Ma, Ze-Jun; Qiu, Shi; Zhang, Lian-Ji; Zhang, Shang-Zhou \| 收藏 \| 浏览/下载：30/0 \| 提交时间：2022/07/14 Phase decomposition High entropy alloy First-principles calculations Thermodynamic modeling Strengthening
	First-principles modeling of the hydrogen evolution reaction and its application in electrochemical corrosion of Mg 期刊论文 OAI收割 ACTA MATERIALIA, 2020, 卷号: 183, 页码: 377-389 作者: Ma, Hui; Wu, Liping; Liu, Chen; Liu, Mingfeng; Wang, Changgang \| 收藏 \| 浏览/下载：17/0 \| 提交时间：2021/02/02 Electrochemical corrosion First-principles modeling Hydrogen evolution reaction Anodic dissolution reaction Mg-based alloys
	First-principles modeling of anisotropic anodic dissolution of metals and alloys in corrosive environments 期刊论文 OAI收割 ACTA MATERIALIA, 2017, 卷号: 130, 页码: 137-146 Ma, Hui; Chen, Xing-Qiu; Li, Ronghan; Wang, Shoulong; Dong, Junhua; Ice, Wei 收藏 \| 浏览/下载：36/0 \| 提交时间：2017/08/17 Corrosion Modeling First-principles calculations Mg-based alloys
	First principles study of p-type doping in SiC nanowires: role of quantum effect 期刊论文 OAI收割 journal of nanoparticle research, JOURNAL OF NANOPARTICLE RESEARCH, 2011, 2011, 卷号: 13, 13, 期号: 7, 页码: 2887-2892, 2887-2892 作者: Wang ZG; Xue SW; Li JB; Gao F \| 收藏 \| 浏览/下载：56/4 \| 提交时间：2011/07/07 SiC nanowires Sic Nanowires P-type Doping First Principles Modeling And Simulation p-type doping First principles Modeling and simulation