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清华大学 [13]

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	Atomic Simulations of the Interaction between a Dislocation Loop and Vacancy-Type Defects in Tungsten 期刊论文 METALS, 2022, 卷号: 12 作者: Li, Linyu; Wang, Hao; Xu, Ke; Li, Bingchen; Jin, Shuo 收藏 \| 浏览/下载：24/0 \| 提交时间：2022/05/05 atomic simulations dislocation loop vacancy defect tungsten
	Molecular dynamics simulation of the effect of process parameters on Ni/Fe metal thermal spraying 期刊论文 Rare Metal Materials and Engineering, 2021, 卷号: 50, 期号: 6, 页码: 1896-1903 作者: Ruicheng Feng; Jianyong Dong; Haiyan Li; Yun Dong; Chunli Lei 收藏 \| 浏览/下载：6/0 \| 提交时间：2021/09/03 Cluster analysis Melting point Molecular dynamics Morphology Speed Atomic clusters Deposition process Disordered atoms Effects of temperature Molecular dynamics simulations Process parameters Spraying process Sub-surface damage
	Influence of temperature on mechanical properties of nanocrystalline 316l stainless steel investigated via molecular dynamics simulations 期刊论文 Materials, 2020, 卷号: 13, 期号: 12, 页码: 1-16 作者: Husain, Abdelrahim; La, Peiqing; Hongzheng, Yue; Jie, Sheng 收藏 \| 浏览/下载：2/0 \| 提交时间：2020/12/18 Deformation Grain boundary sliding Grain size and shape Molecular dynamics Nanocrystals Twinning Yield stress316 L stainless steel Deformation twinning Dominant deformation mechanism Extended dislocations Increasing temperatures Inter-atomic bonding Inter-atomic distances Molecular dynamics simulations
	Multilayer boron nitride nanofilm as an effective barrier for atomic oxygen irradiation 期刊论文 Applied Surface Science, 2020, 卷号: 504 作者: Cheng, Li; Shi, Yanbin; Hao, Yu; Li, Wensheng; Ren, Siming 收藏 \| 浏览/下载：14/0 \| 提交时间：2020/11/14 Atoms Boron nitride III-V semiconductors Irradiation Molecular dynamics Molecular oxygen Monolayers Multilayer films Multilayers Nitrides Organic polymers Oxidation Oxidation resistance Anti-oxidation AO irradiations Atomic oxygen Atomic oxygen irradiation Barrier performance Molecular dynamics simulations Nano films Structural analogue
	Length feature of ssDNA adsorption onto graphene oxide with both large unoxidized and oxidized regions 期刊论文 NANOSCALE, 2020, 卷号: 12, 期号: 12, 页码: 6699-6707 作者: Lei, XL; Ma, HS; Fang, HP 收藏 \| 浏览/下载：36/0 \| 提交时间：2021/09/06 SINGLE-STRANDED-DNA MOLECULAR-DYNAMICS CARBON NANOTUBE ATOMIC-STRUCTURE MEMBRANES BINDING SURFACE FUNCTIONALIZATION NANOCOMPOSITES SIMULATIONS
	Molecular dynamics simulation of lateral ultrasonic excitation in atomic-scale friction 期刊论文 Materials Research Express, 2020, 卷号: 7, 期号: 1 作者: Wang, Zining; Duan, Zaoqi; Dong, Yun; Zhang, Yan 收藏 \| 浏览/下载：6/0 \| 提交时间：2020/11/14 Atoms Computer simulation Friction Molecular physics Nanotribology Potential energy Quantum chemistry Ultrasonic effects Atomic scale frictions Interaction potentials Lateral excitation Molecular dynamics simulations Numerical computations Superlubricity Ultrasonic excitation Ultrasonic vibration
	Nanoindentation of -TiAl with different crystal surfaces by molecular dynamics simulations 期刊论文 Materials, 2019, 卷号: 12, 期号: 5 作者: Fan, Xiaocui; Rui, Zhiyuan; Cao, Hui; Fu, Rong; Feng, Ruicheng 收藏 \| 浏览/下载：11/0 \| 提交时间：2020/11/14 Density (specific gravity) Elastic moduli Hardness Molecular dynamics Molecular orientation Nanoindentation Stacking faults Strain energy Unloading Atomic arrangement Deformation mechanism Hardness and elastic modulus Load-depth curves Molecular dynamics simulations Orientation dependence Prismatic dislocation loop Stacking fault tetrahedron
	hcp ? ? phase transition mechanisms in shocked zirconium: A machine learning based atomic simulation study 期刊论文 Acta Materialia, 2019, 卷号: 162, 页码: 126-135 作者: Zong, Hongxiang; Luo, Yufei; Ding, Xiangdong; Lookman, Turab; Ackland, Graeme J. 收藏 \| 浏览/下载：16/0 \| 提交时间：2019/11/19 Anisotropic phase transitions Atomic simulations Direct measurement Interatomic potential Molecular dynamics simulations Omega transformations Orientation relationship Shock compressions
	Molecular dynamics simulation and experimental verification for bonding formation of solid-state TiO2 nano-particles induced by high velocity collision 期刊论文 Ceramics International, 2019, 卷号: 45, 页码: 4700-4706 作者: Yao, Hai-Long; Yang, Guan-Jun; Li, Chang-Jiu 收藏 \| 浏览/下载：36/0 \| 提交时间：2019/11/19 Atomic displacement Chemical bondings Compressive pressure High velocity collisions MD simulation Molecular dynamics simulations Nano ceramic particles Particle deformation
	Structure and shear response of tilt grain boundary in titanium nitride 期刊论文 Ceramics International, 2019, 卷号: 45, 页码: 5531-5546 作者: Zhang, Lei; Wang, Liang; Yu, Wenshan; Shen, Shengping; Fu, Tao 收藏 \| 浏览/下载：21/0 \| 提交时间：2019/11/19 Atomic deformation Deformation couplings Deformation modes Edge dislocation cores Geometrical analysis Molecular dynamics simulations Tilt grain boundary Vacancy emissions

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