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Calculation of Elastic Modulus of Nanostructural Elements by the Method of Matching of Solutions to Boundary Value Elasticity Problems and Molecular Dynamics Problems
Technical Physics ( IF 0.7 ) Pub Date : 2024-01-20 , DOI: 10.1134/s1063784223700123
A. V. Vakhrushev , A. A. Shushkov

Abstract—

The technique for calculating elastic constant of structural nanolements is developed based on the matching of the nanoelement displacement fields obtained by molecular dynamics method with elasticity calculation. The solution matching is performed by varying the elastic modulus. The dependences of the elastic modulus of nanoparticles on their diameter are obtained.



中文翻译:

用边值弹性问题和分子动力学问题解匹配的方法计算纳米结构单元的弹性模量

摘要-

基于分子动力学方法获得的纳米元件位移场与弹性计算的匹配,发展了计算结构纳米元件弹性常数的技术。通过改变弹性模量来执行解匹配。获得了纳米粒子的弹性模量对其直径的依赖性。

更新日期:2024-01-20
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