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arXiv 0704.1840cond-mat.softcond-mat.mtrl-sci
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polymer玻璃的老化和塑性形变模拟

Simulations of aging and plastic deformation in polymer glasses

Mya Warren, Joerg Rottler

摘要:

我们使用分子动力学模拟研究物理老化对模型聚合物玻璃力学性能的影响。蠕变柔量与恒定温度下低于屈服的恒定单轴载荷下的结构松弛同时确定。该模型成功地捕捉到了聚合物玻璃中实验发现的普遍特征,包括机械复原的特征。我们分析了微观松弛时间尺度,并表明它们表现出相同的宏观蠕变遵守老化特性。此外,我们的模型表明,整个分布的弛豫时间尺度与年龄相同。尽管流动性的变化很大,我们观察到相对较小的结构变化,除了一个弱的对数增加的程度,短程秩序,可能与观察到的减少老化增加负荷。

英文摘要:

We study the effect of physical aging on the mechanical properties of a model polymer glass using molecular dynamics simulations. The creep compliance is determined simultaneously with the structural relaxation under a constant uniaxial load below yield at constant temperature. The model successfully captures universal features found experimentally in polymer glasses, including signatures of mechanical rejuvenation. We analyze microscopic relaxation timescales and show that they exhibit the same aging characteristics as the macroscopic creep compliance. In addition, our model indicates that the entire distribution of relaxation times scales identically with age. Despite large changes in mobility, we observe comparatively little structural change except for a weak logarithmic increase in the degree of short-range order that may be correlated to an observed decrease in aging with increasing load.

机构、总结、中文摘要均由AI分析而来,可能存在错误,请以论文正文为准。

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