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Elastic constants of incommensurate solid 4He from diffusion Monte Carlo simulations

机译:来自扩散蒙特卡罗模拟的不相称固体4He的弹性常数

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摘要

We study the elastic properties of incommensurate solid 4He in the limit of zero temperature. Specifically, we calculate the pressure dependence of the five elastic constants (C11, C12, C13, C33, and C44), longitudinal and transversal speeds of sound, and the T=0 Debye temperature of incommensurate and commensurate hcp 4He using the diffusion Monte Carlo method. Our results show that under compression, the commensurate crystal is globally stiffer than the incommensurate, however at pressures close to melting (i.e., P∼25 bar) some of the elastic constants accounting for strain deformations of the hcp basal plane (C12 and C13) are slightly larger in the incommensurate solid. Also, we find that upon the introduction of tiny concentrations of point defects, the shear modulus of 4He (C44) undergoes a small reduction.
机译:我们研究了零温度范围内不相称的固体4He的弹性。具体来说,我们使用扩散蒙特卡罗方法计算了五个弹性常数(C11,C12,C13,C33和C44)的压力依赖性,声音的纵向和横向速度以及不等和相称hcp 4He的T = 0德拜温度。方法。我们的结果表明,在压缩下,相称的晶体整体上比不相称的晶体坚硬,但是在接近融化的压力(即P〜25 bar)下,一些弹性常数解释了hcp基面的应变变形(C12和C13)在不相称的实体中稍大。此外,我们发现在引入极少量的点缺陷后,4He(C44)的剪切模量经历了较小的降低。

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