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Alloying Effect on the Stability of Ti5Si3 from First-Principles Study 期刊论文
PHYSICA STATUS SOLIDI B-BASIC SOLID STATE PHYSICS, 2022, 页码: 8
Authors:  Cao, Shuo;  Li, Yang;  Zhang, Lian-Ji;  Yang, Yan-Ting;  Liu, Jian-Rong;  Yang, Rui;  Hu, Qing-Miao
Favorite  |  View/Download：52/0  |  Submit date：2022/07/01
alloying  creep resistance  DFT  enthalpy of solution  Ti5Si3  
Phase decomposition and strengthening in HfNbTaTiZr high entropy alloy from first-principles calculations 期刊论文
ACTA MATERIALIA, 2022, 卷号: 225, 页码: 16
Authors:  Chen, Shu-Ming;  Ma, Ze-Jun;  Qiu, Shi;  Zhang, Lian-Ji;  Zhang, Shang-Zhou;  Yang, Rui;  Hu, Qing-Miao
Favorite  |  View/Download：42/0  |  Submit date：2022/07/14
Phase decomposition  High entropy alloy  First-principles calculations  Thermodynamic modeling  Strengthening  
Structural stability and mechanical properties of B2 ordered refractory AlNbTiVZr high entropy alloys 期刊论文
JOURNAL OF ALLOYS AND COMPOUNDS, 2021, 卷号: 886, 页码: 8
Authors:  Qiu, Shi;  Chen, Shu-Ming;  Naihua, Naihua;  Zhou, Jian;  Hu, Qing-Miao;  Sun, Zhimei
Favorite  |  View/Download：137/0  |  Submit date：2021/11/22
Local chemical ordering  High entropy alloy  First-principles calculations  Mechanical properties  
Structural stability and mechanical properties of B2 ordered refractory AlNbTiVZr high entropy alloys 期刊论文
JOURNAL OF ALLOYS AND COMPOUNDS, 2021, 卷号: 886, 页码: 8
Authors:  Qiu, Shi;  Chen, Shu-Ming;  Naihua, Naihua;  Zhou, Jian;  Hu, Qing-Miao;  Sun, Zhimei
Favorite  |  View/Download：138/0  |  Submit date：2021/11/22
Local chemical ordering  High entropy alloy  First-principles calculations  Mechanical properties  
Interaction between Al and other alloying atoms in alpha-Ti for designing high temperature titanium alloy 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2021, 卷号: 197, 页码: 11
Authors:  Cao, Shuo;  Zhang, Shang-Zhou;  Liu, Jian-Rong;  Li, Shu-Jun;  Sun, Tao;  Li, Jian-Ping;  Gao, Yang;  Yang, Rui;  Hu, Qing-Miao
Favorite  |  View/Download：156/0  |  Submit date：2021/10/15
Titanium alloys  Thermal strength  Thermal stability  Interaction energy  First principles calculations  
Twinning pathways in Fe and Fe-Cr alloys from first-principles theory 期刊论文
ACTA MATERIALIA, 2021, 卷号: 215, 页码: 14
Authors:  Wang, Ci;  Schonecker, Stephan;  Li, Wei;  Yang, Yaochun;  Hu, Qing-Miao;  Vitos, Levente
Favorite  |  View/Download：103/0  |  Submit date：2021/10/15
Deformation twinning  Generalized stacking fault energy  Ferrite  Fe-Cr alloys  First-principles calculations  
Generalized stacking fault energies and critical resolved shear stresses of random alpha-Ti-Al alloys from first-principles calculations 期刊论文
JOURNAL OF ALLOYS AND COMPOUNDS, 2021, 卷号: 850, 页码: 11
Authors:  Yu, Hui;  Cao, Shuo;  Youssef, Sabry S.;  Ma, Ying-Jie;  Lei, Jia-Feng;  Qi, Yang;  Hu, Qing-Miao;  Yang, Rui
Favorite  |  View/Download：88/0  |  Submit date：2021/02/02
Generalized stacking fault energy  Critical resolved shear stress  Titanium alloy  First-principles calculations  
Influence of lattice distortion on stacking fault energies of CoCrFeNi and Al-CoCrFeNi high entropy alloys 期刊论文
JOURNAL OF ALLOYS AND COMPOUNDS, 2020, 卷号: 846, 页码: 10
Authors:  Qiu, Shi;  Zhang, Xue-Chun;  Zhou, Jian;  Cao, Shuo;  Yu, Hui;  Hu, Qing-Miao;  Sun, Zhimei
Favorite  |  View/Download：197/0  |  Submit date：2021/02/02
High entropy alloys  Stacking fault energy  Lattice distortion  Density functional theory  
Unconventional non-uniform local lattice distortion in dilute Ti-Mo solid solution 期刊论文
ACTA MATERIALIA, 2020, 卷号: 197, 页码: 91-96
Authors:  Hu, Qing-Miao;  Yang, Rui
Favorite  |  View/Download：67/0  |  Submit date：2021/02/02
Local lattice distortion  Lattice dynamics  Solid solution hardening  Internal friction  First principles calculations  
Design of defected TaN supercells dataset for structural and elastic properties from ab initio simulations and comparison to experimental data. 期刊论文
Data in brief, 2020, 卷号: 30, 页码: 105411-105411
Authors:  Li, Chen-Hui;  Abadias, Gregory;  Belliard, Laurent;  Hu, Qing Miao;  Greneche, Nicolas;  Djemia, Philippe
Favorite  |  View/Download：61/0  |  Submit date：2021/02/03