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Transversely isotropic elastic properties of multi-walled boron nitride nanotubes under a thermal environment

机译:在热环境下多壁氮化硼纳米管的横向各向同性弹性性能

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The temperature-dependent transversely isotropic elastic properties of multi-walled boron nitride nanotubes (MWBNNTs) were determined using molecular dynamics simulations with a three-body Tersoff potential force field. These elastic properties were calculated by applying the four different loading conditions on MWBNNTs: uniaxial tension, torsional moment, in-plane biaxial tension and in-plane shear. The effect of chirality, number of layers and aspect ratio (AR) were taken into consideration. The results reveal that the elastic constants of MWBNNTs decrease as their number of layers increase. The elastic moduli of MWBNNTs do not depend on the AR, but are a function of chirality. Furthermore, the effect of temperature on the transversely isotropic elastic constants of MWBNNTs was studied. Higher temperature considerably affects the mechanical properties of MWBNNTs. For instance, the reduction in the values of axial Young's, longitudinal shear, plane-strain bulk and in-plane shear moduli of MWBNNTs was found to be by approximately 10% due to the increase in temperature. The results reveal that the mechanical properties and failure behavior of MWBNNTs significantly depend on the number of layers, chirality and temperature. The finding of this work can be utilized for engineering MWBNNT-based advanced nanocomposite structures for specific application under thermal environment.
机译:使用具有三体截味的潜在力场的分子动力学模拟测定多壁氮化硼纳米管(MWBNNT)的温度依赖性横向各向同性弹性特性。通过在MWBNNTS上施加四种不同的装载条件来计算这些弹性性质:单轴张力,扭转力矩,面内副胎张力和面内剪切。考虑了手性,层数和纵横比(AR)的影响。结果表明,随着它们的层数增加,MWBNNT的弹性常数减小。 MWBNNT的弹性模量不依赖于AR,而是是手性的函数。此外,研究了温度对MWBNTS横向各向同性弹性常数的影响。较高的温度显着影响MWBNNT的机械性能。例如,由于温度的增加,发现MWBNNT的轴向杨,纵向剪切,平面菌株体积和平面内剪切模量的减小为大约10%。结果表明,MWBNNT的机械性能和失效行为显着取决于层数,手性和温度。该作品的发现可用于工程基于MWBNNT的高级纳米复合材料结构,用于在热环境下的特定应用。

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