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浏览/检索结果: 共9条，第1-9条 帮助 限定条件 发表日期：2018     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 Energetics analysis of interstitial loops in single-phase concentrated solid-solution alloys 期刊论文 JOURNAL OF NUCLEAR MATERIALS, 2018, 卷号: 501, 页码: 94-103 作者:  Wang, XX;  Niu, LL;  Wang, SQ;  Wang, XX (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：25/0  |  提交时间：2018/06/05 Stacking-fault Energy  Radiation-induced Segregation  High-entropy Alloys  Ab-initio Calculations  Ni-based Alloys  Molecular-dynamics  Defect Evolution  Fcc Metals  Gamma-fe  Irradiation   Local Structural Origin of the Crystallization Tendency of Pure and Alloyed Sb 期刊论文 Physica Status Solidi - Rapid Research Letters, 2018 作者:  Ronneberger, Ider;  Chen, Yuhan;  Zhang, Wei;  Mazzarello, Riccardo 收藏  |  浏览/下载：5/0  |  提交时间：2019/11/26 Ab initio molecular dynamics simulation  Amorphous models  Crystallization tendency  Data storage  Simulated Quenching  Structural motifs  Structural origin  Technological applications   Crystal growth of Ge2Sb2Te5 at high temperatures 期刊论文 MRS Communications, 2018, 卷号: 8, 页码: 1018-1023 作者:  Ronneberger, I.;  Zhang, W.;  Mazzarello, R. 收藏  |  浏览/下载：4/0  |  提交时间：2019/11/26 Ab initio molecular dynamics  Electronic storage devices  Finite size effect  High temperature  Metadynamics  State of the art  Storage-class memory  Temperature dependent behavior   Predicting a two-dimensional P2S3 monolayer: A global minimum structure 期刊论文 Computational Materials Science, 2018, 卷号: 155, 页码: 288-292 作者:  Xiao, Hang;  Shi, Xiaoyang;  Zhang, Yayun;  Li, Mingjia;  Liao, Xiangbiao 收藏  |  浏览/下载：4/0  |  提交时间：2019/11/26 2-D crystals  Ab initio molecular dynamics simulation  Born-Oppenheimer  Crystalline phase  Global minimum structure  P2S3  Phonon spectrum  Wide band gap   Applying a new interatomic potential for the simulation of monoclinic and triclinic LiSiO 期刊论文 Materials Chemistry and Physics, 2018, 卷号: Vol.214, 页码: 548-556 作者:  Sheng-Gui Ma;  Xiang-Gang Kong;  Shi-Chang Li;  Yan-Hong Shen;  Xiao-Jun Chen 收藏  |  浏览/下载：3/0  |  提交时间：2019/02/25 Li4SiO4  Pair potential  Ab initio calculations  Molecular dynamics simulations   The prediction of upper limit of copper content in CoBCu glass-forming alloys 期刊论文 COMPUTATIONAL MATERIALS SCIENCE, 2018, 卷号: 152, 页码: 351-354 作者:  Dong, B. S.;  Zhou, S. X.;  Qin, J. Y.;  Chen, H.;  Wang, Y. G. 收藏  |  浏览/下载：5/0  |  提交时间：2019/12/11 Ab initio molecular dynamics  Glass-forming ability  Cu cluster  Nanocrystalline alloy  Quenching   The reassessment of the structural transition regions along the liquidus of Fe-Si alloys and a possible liquid-liquid structural transition in FeSi2 alloy 期刊论文 PHYSICS LETTERS A, 2018, 卷号: 382, 期号: 37, 页码: 2655-2661 作者:  Li, Xinxin;  Wang, Jin;  Qin, Jingyu;  Dong, Bangshao;  Pan, Shaopeng 收藏  |  浏览/下载：1/0  |  提交时间：2019/12/11 Ab initio molecular dynamics simulation  Structural transition  sub-region  Liquid Fe-Si alloys   Insight into the role of W in amorphous GeTe for phase-change memory 期刊论文 JOURNAL OF ALLOYS AND COMPOUNDS, 2018, 卷号: 738, 页码: 270-276 作者:  Zhang, Linchuan;  Miao, Naihua;  Zhou, Jian;  Mi, Jinxiao;  Sun, Zhimei 收藏  |  浏览/下载：11/0  |  提交时间：2019/12/30 Phase-change memory  Data storage materials  Atomic scale structure  ab initio molecular dynamics simulations  Computer simulations   Atomic Structure and Magnetic Properties of the Fe78B13Si9 Amorphous Alloy Surface 期刊论文 JOURNAL OF PHYSICAL CHEMISTRY C, 2018, 卷号: 122, 页码: 28613-28618 作者:  Li, Xuan;  Zuo, Lei;  Zhang, Xin;  Zhang, Tao 收藏  |  浏览/下载：4/0  |  提交时间：2019/12/30 Amorphous alloys  Atoms  Binary alloys  Magnetic moments  Magnetic properties  Molecular dynamics  Silicon alloys  Ab initio molecular dynamics simulation  Degree of order  Local density of state  Low coordination  Lower average  Rhomboidal symmetry  Surface components  Iron alloys