Sample Geometry and the Brittle-Ductile Behavior of Edge Cracks in 3D Atomistic Simulations by Molecular Dynamics

PELIKáN Vladimir; HORA Petr; MACHOVá Anna; KOLMAN Radek; UHNáKOVá Alena

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Sample Geometry and the Brittle-Ductile Behavior of Edge Cracks in 3D Atomistic Simulations by Molecular Dynamics

机译：分子动力学的3D原子模拟中的样品几何形状和边缘裂纹的脆性-脆性行为

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We present new results of molecular dynamic (MD) simulations in 3D bcc iron crystals with edge cracks (001)[010] and (-110)[110] loaded in mode I. Different sample geometries of SEN type were tested with negative and positive values of T-stress according to continuum prediction by Fett.

机译：我们介绍了在模式I中加载的带有边缘裂纹（001）[010]和（-110）[110]的3D bcc铁晶体中分子动力学（MD）模拟的新结果。测试了SEN类型的不同样品几何形状的正负根据Fett的连续性预测得出的T应力值。

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《Diffusion and Defect Data. Solid State Data, Part B. Solid State Phenomena》 |2016年第null期|共4页
作者
PELIKáN Vladimir; HORA Petr; MACHOVá Anna; KOLMAN Radek; UHNáKOVá Alena;
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正文语种 eng
中图分类半导体物理学;
关键词
bcc iron; crack growth; dislocation emission; twins;

机译：密件抄送铁;裂纹扩展;位错排放;孪晶;

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1. Sample Geometry and the Brittle-Ductile Behavior of Edge Cracks in 3D Atomistic Simulations by Molecular Dynamics [J] . PELIKáN Vladimir, HORA Petr, MACHOVá Anna, Diffusion and Defect Data. Solid State Data, Part B. Solid State Phenomena . 2016,第Null期

机译：分子动力学的3D原子模拟中的样品几何形状和边缘裂纹的脆性-脆性行为
2. Atomistic Observation of the Lithiation and Delithiation Behaviors of Silicon Nanowires Using Reactive Molecular Dynamics Simulations [J] . Jung Hyun, Lee Minho, Yeo Byung Chul, The journal of physical chemistry, C. Nanomaterials and interfaces . 2015,第7期

机译：利用反应分子动力学模拟对硅纳米线的锂化和脱锂行为的原子观察
3. Atomistic simulations of the Fe K-edge EXAFS in FeF3 using molecular dynamics and reverse Monte Carlo methods [J] . Jonane Inga, Timoshenko Janis, Kuzmin Alexei Physica Scripta: An International Journal for Experimental and Theoretical Physics . 2016,第10期

机译：使用分子动力学和反向蒙特卡洛方法对FeF3中的Fe K-edge EXAFS进行原子模拟
4. Sample Geometry and the Brittle-Ductile Behavior of Edge Cracks in 3D Atomistic Simulations by Molecular Dynamics [C] . PELIKAN Vladimir, HORA Petr, MACHOVA Anna, International Conference on Materials Structure Micromechanics of Fracture . 2017

机译：分子动力学在3D原子模拟中边缘裂缝的样品几何和脆性延展性
5. Studying the Scratching Behavior of Nb/Nbc Nanolaminate Using Molecular Dynamics Atomistic Simulations [D] . ?Uddin, Md Mesbah 2020

机译：使用分子动力学原子模拟研究Nb / Nbc纳米烷基酸的刮擦行为
6. Aggregation behavior of amphiphilic cyclodextrins in a nonpolar solvent: evidence of large-scale structures by atomistic molecular dynamics simulations and solution studies [O] . Giuseppina Raffaini, Fabio Ganazzoli, Antonino Mazzaglia 2016

机译：两性环糊精在非极性溶剂中的聚集行为：通过原子分子动力学模拟和溶液研究证明大规模结构
7. Quantifying Pore Width Effects on Diffusivity via a Novel 3D Stochastic Approach with Input from Atomistic Molecular Dynamics Simulations [O] . -1

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8. Phase behavior and molecular scale dynamics of confined fluids using new atomistic simulation techniques: CRADA No. 1140 close-out report. [R] . Heffelfinger, G. S., Peterson, B. K., Lewitt, M. E. 1977

机译：使用新的原子模拟技术的受限流体的相行为和分子尺度动力学：CRaDa No. 1140特写报告。

Sample Geometry and the Brittle-Ductile Behavior of Edge Cracks in 3D Atomistic Simulations by Molecular Dynamics

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