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浏览/检索结果: 共9条，第1-9条 帮助 限定条件 学科主题：Materials Science, Multidisciplinary     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 First-principles investigations of omega variant selection during athermal beta -> omega transformation of binary Ti-xMo alloy 期刊论文 COMPUTATIONAL MATERIALS SCIENCE, 2018, 卷号: 155, 页码: 524-533 作者:  Zhu, JL;  Cao, S;  Wang, YZ;  Yang, R;  Hu, QM 收藏  |  浏览/下载：216/0  |  提交时间：2018/12/25 Titanium alloys  Phase transformation  Variant selection  First-principles calculation   Experimental and computational investigations of LaNi5-xAlx (x=0, 0.25, 0.5, 0.75 and 1.0) tritium-storage alloys 期刊论文 JOURNAL OF MATERIALS SCIENCE & TECHNOLOGY, 2018, 卷号: 34, 期号: 9, 页码: 1699-1712 作者:  Liu, GL;  Chen, DM;  Wang, YM;  Yang, K 收藏  |  浏览/下载：18/0  |  提交时间：2018/12/25 Hydrogen isotope storage material  Electron structure calculation  Thermodynamic property calculation   Revealing the local lattice strains and strengthening mechanisms of Ti alloys 期刊论文 COMPUTATIONAL MATERIALS SCIENCE, 2018, 卷号: 152, 页码: 169-177 作者:  Zou, CX;  Li, JS;  Wang, WY;  Zhang, Y;  Tang, B 收藏  |  浏览/下载：185/0  |  提交时间：2018/12/25 High-strength Ti alloy  Solid solution strengthening  Grain refinement hardening  Bonding charge density  Lattice distortion  Yield strength   Computational design and property predictions for two-dimensional nanostructures 期刊论文 MATERIALS TODAY, 2018, 卷号: 21, 期号: 4, 页码: 391-418 作者:  Xu, RZ;  Zou, XL;  Liu, BL;  Cheng, HM 收藏  |  浏览/下载：16/0  |  提交时间：2018/12/25 The cluster-plus-glue-atom models of solid solution CuNi alloys: A first-principles study 期刊论文 COMPUTATIONAL MATERIALS SCIENCE, 2018, 卷号: 143, 页码: 439-445 作者:  Lu, J;  Ma, SY;  Wang, XX;  Wang, SQ;  Ma, SY (reprint author), Chinese Acad Sci, Inst Met Res, Shenyang Natl Lab Mat Sci, Shenyang 110016, Liaoning, Peoples R China. 收藏  |  浏览/下载：38/0  |  提交时间：2018/06/05 Molecular-dynamics Simulation  Quasi-random Structures  Bulk Metallic Glasses  Composition Formulas  Ni Alloys  Approximation   Understanding the improved stability and reduced thermal conductivity of yttria stabilized zirconia: A combined experimental and atomistic modeling study 期刊论文 COMPUTATIONAL MATERIALS SCIENCE, 2018, 卷号: 153, 页码: 208, 216 作者:  Gul, Sahar Ramin;  Khan, Matiullah;  Zeng, Yi;  Wu, Bo 收藏  |  浏览/下载：20/0  |  提交时间：2018/12/28 8YSZ  Density functional theory  Oxygen vacancy  Thermal conductivity  Thermal stability   Determination of adsorption-controlled growth windows of chalcogenide perovskites 期刊论文 MRS COMMUNICATIONS, 2018, 卷号: 8, 期号: 1, 页码: 145, 151 作者:  Filippone, Stephen A.;  Sun, Yi-Yang;  Jaramillo, R. 收藏  |  浏览/下载：19/0  |  提交时间：2018/12/28 Atomic self-diffusion anisotropy of HCP metals from first-principles calculations 期刊论文 COMPUTATIONAL MATERIALS SCIENCE, 2017, 卷号: 128, 页码: 236-242 Zhang, Lian-Ji; Spiridonova, Tatiana I.; Kulkova, Svetlana E.; Yang, Rui; Hu, Qing-Miao 收藏  |  浏览/下载：21/0  |  提交时间：2017/08/17 Atomic diffusion  HCP metals  First-principles calculations   CPA descriptions of random Cu-Au alloys in comparison with SQS approach 期刊论文 COMPUTATIONAL MATERIALS SCIENCE, 2017, 卷号: 128, 页码: 302-309 Tian, Li-Yun; Ye, Li-Hua; Hu, Qing-Miao; Lu, Song; Zhao, Jijun; Vitos, Levente 收藏  |  浏览/下载：91/0  |  提交时间：2017/08/17 Local lattice distortion  Formation enthalpy  Elastic constant  Special quasi-random structure (SQS)  Cu-Au alloys