机构

• 地质与地球物理研究所 [3]
• 金属研究所 [2]
• 物理研究所 [1]
• 苏州纳米技术与纳米仿... [1]
• 长春光学精密机械与物... [1]
• 地球化学研究所 [1]
• 更多

采集方式

• OAI收割 [9]
• iSwitch采集 [1]

内容类型

• 期刊论文 [9]
• 会议论文 [1]

发表日期

• 2019 [1]
• 2017 [2]
• 2016 [1]
• 2012 [1]
• 2011 [3]
• 2010 [1]
• 更多

学科主题

• Materials ... [1]
• Physics, A... [1]
• 半导体物理 [1]

筛选

浏览/检索结果: 共10条，第1-10条 帮助 条数/页： 5101520253035404550556065707580859095100 排序方式： 请选择题名升序题名降序提交时间升序提交时间降序作者升序作者降序发表日期升序发表日期降序 A metastable Fo-III wedge in cold slabs subducted to the lower part of the mantle transition zone: A hypothesis based on first-principles simualtions 期刊论文  OAI收割 Minerals, 2019, 卷号: 9, 期号: 3, 页码: 1-29 作者:  Yining Zhang;  Yanyao Zhang;  Yun Liu;  Xi Liu   |  收藏  |  浏览/下载：17/0  |  提交时间：2020/09/02 Cold Slabs  Crystallographic Feature And Structural Evolution  FIrst-principles Simulation  Metastable Olivine Wedge  Metastable Fo-iii Wedge  Thermodynamic Properties  mantle Transition Zone   A new Ca3MgSi2O8 compound and some of its thermodynamic properties 期刊论文  OAI收割 JOURNAL OF SOLID STATE CHEMISTRY, 2017, 卷号: 255, 页码: 145-149 作者:  Bao, Xinjian;  Zhang, Yanyao;  Zhang, Zhigang;  Zhang, Lifei;  Liu, Xiaoyang   |  收藏  |  浏览/下载：34/0  |  提交时间：2017/11/24 New Ca3MgSi2Os compound  Single-crystal X-ray diffraction  First-principles simulation  Compressibility  Heat capacity  Standard vibrational entropy   Interpreting radiation-induced segregation and enhanced radiation tolerance of single-phase concentrated solid-solution alloys from first principles 期刊论文  OAI收割 MATERIALS LETTERS, 2017, 卷号: 202, 页码: 120-122 Wang, Xin-Xin; Niu, Liang-Liang; Wang, Shaoqing 收藏  |  浏览/下载：34/0  |  提交时间：2017/08/17 Simulation and modelling  Microstructure  First principles  Interstitial defects  Single-phase concentrated solid-solution alloy   First principles study of the c/si ratio effect on the ideal shear strength of β–sic 期刊论文  iSwitch采集 Materials research express, 2016, 卷号: 3, 期号: 7 作者:  Su,Wen;  Li,Yingying;  Nie,Chu;  Xiao,Wei;  Yan,Liqin 收藏  |  浏览/下载：84/0  |  提交时间：2019/05/09 First principles calculation  Monte carlo simulation  Non-stoichiometric  Ideal shear strength  Sic   Numerical simulations for adaptive optics system (EI CONFERENCE) 会议论文  OAI收割 31st Chinese Control Conference, CCC 2012, July 25, 2012 - July 27, 2012, Hefei, China 作者:  Wang X.-J. 收藏  |  浏览/下载：27/0  |  提交时间：2013/03/25 The simulation methods for the adaptive optics (AO) system are studied. Based on the global structure of the AO system  the key principles for each module are first discussed systematically  including the wave propagation principles  wave-front representation  coordinates transformation between the coordinates considered  wave-front reconstruction algorithm and DM principles. The purpose of these discussions is to establish the theoretical foundations for the numerical simulations of the AO system. Then the simulation steps are described in detail and a series of numerical simulation results are given which validate the effectiveness of our simulation work. 2012 Chinese Assoc of Automati.   A first-principles study of the phase transition from Holl-I to Holl-II in the composition KAlSi3O8 期刊论文  OAI收割 AMERICAN MINERALOGIST, 2011, 卷号: 96, 期号: 7, 页码: 974-982 作者:  Deng, Liwei;  Liu, Xi;  Liu, Hong;  Zhang, Yigang   |  收藏  |  浏览/下载：15/0  |  提交时间：2018/09/26 Equation of state  first-principles simulation  Holl-I  Holl-II  phase transition   A first-principles study of the phase transition from Holl-I to Holl-II in the composition KAlSi3O8 期刊论文  OAI收割 AMERICAN MINERALOGIST, 2011, 卷号: 96, 期号: 7, 页码: 974-982 作者:  Deng, Liwei;  Liu, Xi;  Liu, Hong;  Zhang, Yigang   |  收藏  |  浏览/下载：11/0  |  提交时间：2018/09/26 Equation of state  first-principles simulation  Holl-I  Holl-II  phase transition   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：54/4  |  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   First principles calculations of electronic and optical properties of Mo-doped rutile TiO2 期刊论文  OAI收割 Journal of Alloys and Compounds, 2010, 卷号: 507, 期号: 1, 页码: 33-37 作者:  Kong JJ (孔俊杰) 收藏  |  浏览/下载：14/0  |  提交时间：2010/12/31 Rutile TiO2  Mo-doped  First principles  Electronic structures and optical properties  Computer simulation   The electronic effect of N impurity in an < 100 > edge dislocation core system in alpha-iron 期刊论文  OAI收割 Computational Materials Science, 2001, 卷号: 22, 期号: 3-4, 页码: 144-150 Y. Niu; S. Y. Wang; D. L. Zhao; C. Y. Wang 收藏  |  浏览/下载：23/0  |  提交时间：2012/04/14 structure relaxation  electronic structure  edge dislocation core  system  first-principles method  alpha-iron  bcc transition-metals  hcp metals  computer-simulation  screw-dislocation  local-density  grain-boundaries  energy  hydrogen  ni3al  fe