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| Atomistic Insights on Surface Quality Control via Annealing Process in AlGaN Thin Film Growth 期刊论文
NANOMATERIALS, 2023, 卷号: 13, 期号: 8, 页码: 1382
作者: Peng Q(彭庆); Ma ZW(马知未) ; Cai, Shixian; Zhao S(赵帅); Chen, Xiaojia; Cao, Qiang
 Adobe PDF(2490Kb) |  收藏 | 浏览/下载：38/0 | 提交时间：2023/06/15
AlGaN thin film molecular dynamics simulations laser annealing atomistic structure |
| Low-Density Multilayer Graphdiyne Film with Excellent Energy Dissipation Capability under Micro-Ballistic Impact 期刊论文
ADVANCED FUNCTIONAL MATERIALS, 2023, 页码: 9
作者: Xiao KL(肖凯璐); Jin, Weiyue; Liu, Huibiao; Huang CG(黄晨光); Li, Yuliang; Wu XQ(吴先前)
Adobe PDF(2677Kb) | 收藏 | 浏览/下载：146/1 | 提交时间：2023/02/20
dynamic energy dissipation capacity failure morphologies microprojectile impact testing molecular dynamics simulations multilayer graphdiyne |
| Coupled Strengthening Effects by Lattice Distortion, Local Chemical Ordering, and Nanoprecipitates in Medium-Entropy Alloys 期刊论文
FRONTIERS IN MATERIALS, 2021, 卷号: 8, 页码: 12
作者: Cheng WQ(程文强); Yuan FP(袁福平); Wu XL(武晓雷)
Adobe PDF(4230Kb) | 收藏 | 浏览/下载：200/38 | 提交时间：2022/01/13
high-entropy alloys lattice distortion local chemical ordering precipitation strengthening mechanisms molecular dynamics simulations |
| Deformation induced hcp nano-lamella and its size effect on the strengthening in a CoCrNi medium-entropy alloy 期刊论文
JOURNAL OF MATERIALS SCIENCE & TECHNOLOGY, 2021, 卷号: 82, 页码: 122-134
作者: Ma Y(马彦); Yang MX(杨沐鑫); Yuan FP(袁福平); Wu XL(武晓雷)
Adobe PDF(10900Kb) | 收藏 | 浏览/下载：303/80 | 提交时间：2021/08/03
Strengthening mechanisms Phase transformation Twinning Medium entropy alloys Molecular dynamics simulations |
| Grain boundary-mediated plasticity accommodating the cracking process in nanograined gold: In situ observations and simulations 期刊论文
SCRIPTA MATERIALIA, 2021, 卷号: 194, 页码: 6
作者: Yang Xu-Sheng; Yuan Shuqing; Fu Hui; Wang YJ(王云江)
Adobe PDF(4682Kb) | 收藏 | 浏览/下载：257/64 | 提交时间：2021/05/06
Nanocrystalline metal Crack propagation Plastic deformation, In situ transmission electron microscope Molecular dynamic simulations |
| Multi-scale molecular dynamics simulations and applications on mechanosensitive proteins of integrins* 期刊论文
CHINESE PHYSICS B, 2021, 卷号: 30, 期号: 3, 页码: 8
作者: Lv SQ(吕守芹); Ding QH(丁奇寒); Zhang MK(张明坤); Long M(龙勉)
Adobe PDF(834Kb) | 收藏 | 浏览/下载：261/82 | 提交时间：2021/04/19
molecular dynamics simulations mechanosensitive protein allosteric dynamics integrin |
| Atomic-level structural identification for prediction of localized shear deformation in metallic glasses 期刊论文
INTERNATIONAL JOURNAL OF SOLIDS AND STRUCTURES, 2020, 卷号: 191, 页码: 363-369
作者: Shi RH(史荣豪); Xiao P(肖攀); Yang R(杨荣); Bai YL(白以龙)
Adobe PDF(1719Kb) | 收藏 | 浏览/下载：396/52 | 提交时间：2020/05/18
Metallic glasses Shear transformation zones Nonaffine displacement Molecular simulations Dynamical matrix |
| Rotation of nanoflake driven by strain gradient fields in locally-indented graphene 期刊论文
Nanotechnology, 2020, 卷号: 31, 期号: 1, 页码: 15303
作者: Khan MB; Wang S; Wang C(王超); Chen SH(陈少华)
Adobe PDF(1893Kb) | 收藏 | 浏览/下载：507/190 | 提交时间：2019/11/26
strain gradient field graphene substrate nano-rotation nano-indenting molecular dynamic simulations |
| Hydrodynamic Properties of Polymers Screening the Electrokinetic Flow: Insights from a Computational Study 期刊论文
POLYMERS, 2019, 卷号: 11, 期号: 6, 页码: 13
作者: Wu P; Sun T; Jiang XK(蒋玺恺); Kondrat S
 浏览 | Adobe PDF(858Kb) | 收藏 | 浏览/下载：221/88 | 提交时间：2019/09/09
polymeric coatings Stokes radius hydrodynamic shielding molecular dynamics simulations Navier-Stokes-Brinkman model |
| 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
作者: Shuang F(双飞); Xiao P(肖攀); Shi RH; Ke FJ(柯孚久); Bai YL(白以龙)
浏览 | Adobe PDF(5768Kb) | 收藏 | 浏览/下载：545/94 | 提交时间：2019/04/11
Energy minimization Fast inertial relaxation engine method Integration formulations Molecular simulations |
