Molecular dynamics simulation of shear in a pressure-induced amorphous model system

Bustingorry S; Jagla EA; Dominguez D

首页> 外文期刊>Journal of Non-Crystalline Solids: A Journal Devoted to Oxide, Halide, Chalcogenide and Metallic Glasses, Amorphous Semiconductors, Non-Crystalline Films, Glass-Ceramics and Glassy Composites >Molecular dynamics simulation of shear in a pressure-induced amorphous model system

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Molecular dynamics simulation of shear in a pressure-induced amorphous model system

机译：压力诱导非晶模型系统中剪切的分子动力学模拟

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Constant shear rate molecular dynamics simulation for a pressure-induced amorphous model system are presented. In particular, we study the effect of shear rate close to the crystal-to-amorphous transformation. We find that shear may assist the transformation when approaching the mechanical instability point. Amorphous and crystal phases may coexist during steady shear flow, with local shear rearrangements localized in the amorphous phase only, while crystal grains perform overall rotation within the amorphous matrix. (c) 2006 Elsevier B.V. All rights reserved.

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《Journal of Non-Crystalline Solids: A Journal Devoted to Oxide, Halide, Chalcogenide and Metallic Glasses, Amorphous Semiconductors, Non-Crystalline Films, Glass-Ceramics and Glassy Composites》 |2006年第29期|共6页
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Bustingorry S; Jagla EA; Dominguez D;
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正文语种 eng
中图分类晶体学;
关键词
pressure effects; molecular dynamics; rheology; METALLIC-GLASS; INDUCED AMORPHIZATION; ELASTIC-CONSTANTS; PHASE-TRANSITIONS; DEFORMATION; STABILITY; CORE;

机译：压力效应;分子动力学;流变学;金属玻璃;诱导的非晶化;弹性常数;相变;形变;稳定性;核心;

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1. Molecular dynamics simulation of shear in a pressure-induced amorphous model system [J] . Bustingorry S, Jagla EA, Dominguez D Journal of Non-Crystalline Solids: A Journal Devoted to Oxide, Halide, Chalcogenide and Metallic Glasses, Amorphous Semiconductors, Non-Crystalline Films, Glass-Ceramics and Glassy Composites . 2006,第28a29期

机译：压力诱导非晶模型系统中剪切的分子动力学模拟
2. Atomistic Modeling of Crystal-to-Amorphous Transition and Associated Kinetics in the Ni-Nb System by Molecular Dynamics Simulations [J] . X.D.Dai, J.H.Li, B.X.Liu The journal of physical chemistry, B. Condensed matter, materials, surfaces, interfaces & biophysical . 2005,第10期

机译：Ni-Nb系统中晶体到非晶态转变及相关动力学的原子建模分子动力学模拟
3. Nonequilibrium molecular dynamics simulation of shear-induced alignment of amphiphilic model systems - art. no. 061503 [J] . Guo HX., Kremer K., Soddemann T. Physical review, E. Statistical physics, plasmas, fluids, and related interdisciplinary topics . 2002,第6aPta1期

机译：剪切诱导的两亲模型系统比对的非平衡分子动力学模拟-艺术。没有。 061503
4. Nonequilibrium molecular dynamics simulation of shear induced alignment of amphiphilic model systems [C] . International symposium on polymer physics(PP'2002) . 2002

机译：两性模型系统剪切诱导排列的非平衡分子动力学模拟
5. Parallel molecular dynamics simulations of pressure-induced structural transformations in cadmium selenide nanocrystals. [D] . Lee, Nicholas Jabari Ouma. 2005

机译：硒化镉纳米晶体中压力诱导的结构转变的并行分子动力学模拟。
6. The Influence of Crosslink Density on the Failure Behavior in Amorphous Polymers by Molecular Dynamics Simulations [O] . Junhua Zhao, Peishi Yu, Shuhong Dong 2016

机译：分子动力学模拟研究交联密度对非晶态聚合物破坏行为的影响
7. Molecular dynamics simulation for pressure-induced structural transition from C$_{60}$ fullerene into amorphous diamond [O] . Kikuchi, Akihito, Tsuneyuki, Shinji 2001

机译：压力诱导结构转变的分子动力学模拟从C $ _ {60} $富勒烯变成无定形钻石
8. Theoretical studies of amorphous silicon and hydrogenated amorphous silicon with molecular dynamics simulations. [R] . I. Kwon 1991

机译：非晶硅和氢化非晶硅的理论研究与分子动力学模拟。

Molecular dynamics simulation of shear in a pressure-induced amorphous model system

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