无形固体中原子的多重和变化的振动身份
1State Key Laboratory of Nonlinear Mechanics, Institute of Mechanics, Chinese Academy of Sciences, Beijing 100190, China.
The Journal of chemical physics
|January 23, 2025
概括
研究人员根据振动将无形固体中的原子分为低频,亚高频和高频组. 不同的群体表现出不同的重排行为,推进无形可塑性理解超出了简单的软/硬点模型.
科学领域:
- 材料科学 材料科学 材料科学
- 凝聚物质物理学 凝聚物质物理学
- 玻璃物理学 玻璃物理学
背景情况:
- 了解无形固体中的原子结构对于预测材料性质至关重要.
- 在玻璃中无序包装的原子对表征提出了复杂的挑战.
- 以前的模型经常过分简化原子行为,将其视为"软"或"硬"点.
研究的目的:
- 根据它们的振动频率对无形固体中的原子进行分类.
- 为了研究不同原子组在激发下重新排列的趋势.
- 阐明原子结构在无形可塑性中的作用.
主要方法:
- 在模型Cu50Zr50玻璃中分析全频振动模式.
- 原子被分为低频,低频和高频的类别.
- 在激发时跟踪原子的重新排列和转换.
主要成果:
- 确定了具有独特重新排列行为的独特原子组.
- 低频原子在结构上是不利的和聚合的;来自压缩对的高频原子是不稳定的.
- 剪切转换的重新排列从低频原子转变为高频原子.
- 亚高频原子作为稳定的结构骨干.
- 观察到重叠的原子身份和身份之间的转换.
结论:
- 无形固体中的原子结构比简化的软/硬点图片更复杂.
- 振动频率是决定原子行为和可塑性的关键因素.
- 这种分类加深了对无形可塑性机制的理解.
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