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Influence of atomic order on the enthalpy of formation and bulk modulus of the sigma phase 期刊论文
FLUID PHASE EQUILIBRIA, 2018, 卷号: 459, 页码: 238-243
作者:  Liu, W;  Lu, XG;  Boulet, P;  Record, MC;  Hu, QM;  Lu, XG (reprint author), Shanghai Univ, Sch Mat Sci & Engn, Shanghai 200444, Peoples R China.;  Lu, XG (reprint author), Shanghai Univ, State Key Lab Adv Special Steel, Shanghai, Peoples R China.;  Record, MC (reprint author), Univ Toulon & Var, Aix Marseille Univ, CNRS, IM2NP, Marseille, France.
收藏  |  浏览/下载:133/0  |  提交时间:2018/06/05
Close-packed Phases  Potential Model  Molar Volume  Cr Alloys  Fe-cr  Approximation  Superalloys  Systems  Ta  
Thermal vacancy formation enthalpy of random solid solutions: The FePt case 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2018, 卷号: 143, 页码: 206-211
作者:  Luo, HB;  Hu, QM;  Du, J;  Yan, AR;  Liu, JP;  Luo, HB (reprint author), Chinese Acad Sci, Ningbo Inst Mat Technol & Engn, Key Lab Magnet Mat & Devices, Ningbo 315201, Zhejiang, Peoples R China.
收藏  |  浏览/下载:111/0  |  提交时间:2018/06/05
Potential Model  Alloys  Nanoparticles  Coercivity  Transition  Energetics  Metals  Energy  
Cross-slip process in model Ni(Al) solid solution: An embedded-atom method study 期刊论文
Computational Materials Science, 2014, 卷号: 91, 页码: 192-199
作者:  J. P. Du;  C. Y. Wang;  T. Yu
收藏  |  浏览/下载:142/0  |  提交时间:2015/01/14
Atomistic Simulations  Embedded-atom Potential  Cross-slip Process  Model Ni(Al) Solid Solution  Elastic Band Method  Screw Dislocation Intersections  Centered-cubic  Nickel  Minimum Energy Paths  Atomistic Simulations  Molecular-dynamics  Lattice-defects  Saddle-points  Fcc Metals  Hydrogen  
{112} < 1 11 > Twinning during omega to body-centered cubic transition 期刊论文
Acta Materialia, 2014, 卷号: 62, 页码: 122-128
作者:  S. Q. Wu;  D. H. Ping;  Y. Yamabe-Mitarai;  W. L. Xiao;  Y. Yang;  Q. M. Hu;  G. P. Li;  R. Yang
收藏  |  浏览/下载:126/0  |  提交时间:2014/02/19
Twin  Metals And Alloys  Titanium Alloy  Microstructure  First-principles Calculation  Multilayer Stacking-faults  Potential Model  Bcc Metals  Alloy  Deformation  Transformation  Approximation  Martensite  Phase  Twins  
Theoretical investigation of the omega-related phases in TiAl-Nb/Mo alloys 期刊论文
Physical Review B, 2014, 卷号: 90, 期号: 5
作者:  Q. M. Hu;  L. Vitos;  R. Yang
收藏  |  浏览/下载:106/0  |  提交时间:2015/01/14
Total-energy Calculations  Quasi-random Structures  Wave Basis-set  1st-principles Calculations  Potential Model  Stability  Metals  Transformations  Approximation  Aluminides  
The effect of long-range order on the elastic properties of Cu3Au 期刊论文
Journal of Physics-Condensed Matter, 2013, 卷号: 25, 期号: 8
作者:  G. S. Wang;  E. K. Delczeg-Czirjak;  Q. M. Hu;  K. Kokko;  B. Johansson;  L. Vitos
收藏  |  浏览/下载:108/0  |  提交时间:2013/12/24
Coherent-potential Approximation  Au-cu Alloys  Mg Alloys  Constants  Energy  Metals  Gold  Transition  Pressure  Model  
Lattice parameters and relative stability of alpha '' phase in binary titanium alloys from first-principles calculations 期刊论文
Solid State Communications, 2013, 卷号: 159, 页码: 70-75
作者:  C. X. Li;  H. B. Luo;  Q. M. Hu;  R. Yang;  F. X. Yin;  O. Umezawa;  L. Vitos
收藏  |  浏览/下载:117/0  |  提交时间:2013/12/24
Titanium Alloys  First-principles Calculation  Composition Dependence  Martensitic Transformation  Ti-ta Alloys  Martensitic-transformation  Biomedical Applications  Potential Model  High-pressure  Base Alloys  Viii Groups  Nb Alloys  Mo  Alloys  v System  
Magnetic properties and temperature-dependent half-metallicity of Co2Mn(Ga(1-x)Z(x)) (Z = Si, Ge, Sn) from first-principles calculation 期刊论文
Journal of Physics-Condensed Matter, 2013, 卷号: 25, 期号: 15
作者:  H. B. Luo;  Q. M. Hu;  C. M. Li;  B. Johansson;  L. Vitos;  R. Yang
收藏  |  浏览/下载:124/0  |  提交时间:2013/12/24
Exchange Interactions  Heusler Alloys  Ferromagnetic Metals  Tunnel-junctions  Potential Model  Magnetoresistance  Crystal  States  
Composition dependent elastic modulus and phase stability of Ni2MnGa based ferromagnetic shape memory alloys 期刊论文
Science China-Technological Sciences, 2012, 卷号: 55, 期号: 2, 页码: 295-305
作者:  Q. M. Hu;  H. B. Luo;  C. M. Li;  L. Vitos;  R. Yang
收藏  |  浏览/下载:100/0  |  提交时间:2013/02/05
Ni2mnga  Martensitic Transformation  Elastic Modulus  Phase Stability  Density Functional Theory  Martensitic-transformation  Magnetic-properties  Heusler Alloys  1st-principles Investigations  Crystal-structures  Potential Model  Approximation  Mechanics  Behavior  Strain  
Phase stability of Ni-2(Mn1-xFex)Ga: A first-principles study 期刊论文
Physical Review B, 2012, 卷号: 86, 期号: 2
作者:  H. B. Luo;  Q. M. Hu;  C. M. Li;  R. Yang;  B. Johansson;  L. Vitos
收藏  |  浏览/下载:95/0  |  提交时间:2013/02/05
Ni-mn-ga  Shape-memory Alloys  Field-induced Strain  Magnetic-properties  Martensitic-transformation  Crystal-structures  Heusler Alloys  Potential Model  Ni2mnga  Approximation