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| Constitutive behavior predictions of mushy zone during solidification by phase field model and coupled Eulerian-Lagrangian method 期刊论文 COMPUTATIONAL MATERIALS SCIENCE, 2022, 卷号: 201, 页码: 6 Authors: Li, Longfei; Zhang, Ruijie; Wu XQ(吴先前); Gu ZP(谷周澎); Wang, Changsheng; Jiang, Haitao Adobe PDF(8355Kb)  |  Favorite  |  View/Download:377/81  |  Submit date:2021/11/01 Phase Field Model Mushy Zone Constitutive Behavior Coupled Eulerian-Lagrangian |
| Atomistic study of shock Hugoniot in columnar nanocrystalline copper 期刊论文 COMPUTATIONAL MATERIALS SCIENCE, 2021, 卷号: 197, 页码: 8 Authors: Hu JQ(胡剑桥); Chen, Zhen Adobe PDF(5712Kb)  |  Favorite  |  View/Download:209/42  |  Submit date:2021/08/30 Shock Hugoniot Molecular dynamics Columnar nanocrystal Size effect Shielding effect |
| Hardening Ni3Al via complex stacking faults and twinning boundary 期刊论文 COMPUTATIONAL MATERIALS SCIENCE, 2021, 卷号: 188, 页码: 8 Authors: Zhang ZW(张志伟); Fu, Qiang; Wang J(王军); Xiao P(肖攀); Ke FJ(柯孚久); Lu CS(卢春生) Adobe PDF(11488Kb)  |  Favorite  |  View/Download:359/45  |  Submit date:2021/04/07 Ni3Al Complex stacking faults Hardness Twinning boundary Molecular dynamics |
| Temperature-dependent brittle-ductile transition of alpha-graphyne nanotubes under uniaxial tension 期刊论文 COMPUTATIONAL MATERIALS SCIENCE, 2021, 卷号: 187, 页码: 7 Authors: Zhang, Cun; Yang, Bolin; Wang C(王超); Liu, Jinxi; Feng, Wenjie; Fang, Xueqian; Chen, Shaohua Adobe PDF(9380Kb)  |  Favorite  |  View/Download:324/63  |  Submit date:2021/03/03 alpha-Graphyne nanotube Brittle-ductile transition Mechanical property Temperature Atomic structure evolution |
| Influencing factors of droplet aggregation on hierarchical wedge-shaped functional surfaces 期刊论文 COMPUTATIONAL MATERIALS SCIENCE, 2020, 卷号: 175, 页码: 7 Authors: Wang S(王帅); Peng ZL(彭志龙); Li JJ(李建军); Yang YZ(杨亚政); Wang C(王超); Chen SH(陈少华) Adobe PDF(4391Kb)  |  Favorite  |  View/Download:299/123  |  Submit date:2020/05/18 Spontaneous droplet aggregation Functional surface Hierarchical wedge-shaped zone Influencing factors Water collection |
| Modeling of atomistic scale shear failure of Ag/MgO interface with misfit dislocation network 期刊论文 COMPUTATIONAL MATERIALS SCIENCE, 2019, 卷号: 170, 页码: UNSP 109151 Authors: Fu XQ(付雪琼); Liang LH(梁立红); Wei YG(魏悦广) Adobe PDF(3150Kb)  |  Favorite  |  View/Download:451/86  |  Submit date:2019/12/17 Interface energy Interface slip Dislocation network Atomistic simulation |
| Formation and migration of helium pair in bcc Fe from first principle calculations 期刊论文 COMPUTATIONAL MATERIALS SCIENCE, 2019, 卷号: 170, 页码: UNSP 109192 Authors: Li LL; Shi JY; Peng L; Jiang W; Qian GA(钱桂安) Adobe PDF(1512Kb)  |  Favorite  |  View/Download:282/109  |  Submit date:2019/12/17 First-principle Helium pair Migration Bcc Fe |
| Temperature-dependent phase transformation of ice-1h under ultrafast uniaxial compression: A molecular dynamics simulation 期刊论文 COMPUTATIONAL MATERIALS SCIENCE, 2019, 卷号: 162, 页码: 340-348 Authors: Yin QY(殷秋运); Hu LL; Wu XQ(吴先前); Xiao KL(肖凯璐); Huang CG(黄晨光) Adobe PDF(5581Kb)  |  Favorite  |  View/Download:300/77  |  Submit date:2019/05/29 Ice Phase transformation Dynamic behaviour Molecular dynamics |
| Influence of integration formulations on the performance of the fast inertial relaxation engine (FIRE) method 期刊论文 COMPUTATIONAL MATERIALS SCIENCE, 2019, 卷号: 156, 页码: 135-141 Authors: Shuang F(双飞); Xiao P(肖攀); Shi RH; Ke FJ(柯孚久); Bai YL(白以龙) Adobe PDF(5768Kb)  |  Favorite  |  View/Download:618/109  |  Submit date:2019/04/11 Energy minimization Fast inertial relaxation engine method Integration formulations Molecular simulations |
| Atomistic simulation study on the shear behavior of Ag/MgO interface 期刊论文 COMPUTATIONAL MATERIALS SCIENCE, 2018, 卷号: 155, 页码: 116-128 Authors: Fu X Q; Liang LH(梁立红); Wei YG(魏悦广) Adobe PDF(4995Kb)  |  Favorite  |  View/Download:285/115  |  Submit date:2018/12/12 Metal/oxide interface Interface stress Interface shear displacement Misfit dislocation Atomistic simulation |