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浏览/检索结果: 共7条，第1-7条 帮助 限定条件 发表日期：2023     已选(0)清除 条数/页：5101520253035404550556065707580859095100   排序方式：请选择作者升序作者降序题名升序题名降序发表日期升序发表日期降序提交时间升序提交时间降序 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 Mg-3(BixSb1-x)(2)  lattice thermal conductivity  first-principles calculations   Hydrogen trapping in vanadium carbide alloyed with transition metals 期刊论文 NUCLEAR MATERIALS AND ENERGY, 2023, 卷号: 36, 页码: 11 作者:  Tang, Shuai;  Li, Linxian;  Yan, Haile;  Jin, Jianfeng;  Peng, Qing 收藏  |  浏览/下载：9/0  |  提交时间：2023/11/28 Hydrogen barrier coating  Vanadium carbide  First-principles calculations  Transition-metal alloying   Active-learning search for unitcell structures: A case study on Mg3Bi2-xSbx 期刊论文 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：11/0  |  提交时间：2023/07/17 Crystal structure prediction  First -principles calculations  Mg-Bi-Sb alloy  Active learning strategy  Unitcell modeling   Calculation and prediction of sliding energy barriers by ffrst-principles combined with machine learning 期刊论文 Ceramics International, 2023, 期号: 49, 页码: 24752–24761 作者:  Yuan Niu;  Yun Wang;  Minjuan He;  Wenhao He;  Zhenghua Zha 收藏  |  浏览/下载：1/0  |  提交时间：2024/01/02 First-principles calculations  Machine learning  Maximum sliding energy barrier  Elemental 2D materials  Friction  Interfacial charge transfer   Unconventional energetics of small vacancy clusters in BCC high-entropy alloy Nb0.75ZrTiV0.5 期刊论文 JOURNAL OF MATERIALS SCIENCE & TECHNOLOGY, 2023, 卷号: 146, 页码: 61-71 作者:  Shi, Tan;  Qiu, Xi;  Zhou, Yundi;  Lyu, Sixin;  Li, Jing 收藏  |  浏览/下载：90/0  |  提交时间：2023/06/15 Refractory high-entropy alloys  Small vacancy clusters  First-principles calculations  Defect energetics  Radiation defect evolution   Green hydrophobic deep eutectic solvents as low-viscosity and efffcient lubricants 期刊论文 Tribology International, 2023, 期号: 185, 页码: 108531 作者:  Yuting Li;  Cheng Cao;  Meng Cai;  Hao Li;  Xiaoqiang Fan 收藏  |  浏览/下载：3/0  |  提交时间：2024/01/02 Green lubricants  Hydrophobic deep eutectic solvents  Ultra-low viscosity  Anti-wear mechanism  First-principles calculations   The effect of loading modes on the strain-dependent energy gap of CdTe quantum dots: A first-principles study 期刊论文 COMPUTATIONAL MATERIALS SCIENCE, 2023, 卷号: 217, 页码: 7 作者:  Wang, Jundiao;  Shi, Ronghao;  Xiao, Pan 收藏  |  浏览/下载：15/0  |  提交时间：2023/02/20 CdTe quantum dots  First-principles calculations  Strain-dependent energy gap  Loading modes