在扩散的非平衡热力学中局部平衡近似
Kim R Kristiansen1, Bjørn Hafskjold1
1PoreLab, Department of Chemistry, Norwegian University of Science and Technology (NTNU), N-7491 Trondheim, Norway.
Entropy (Basel, Switzerland)
|April 26, 2025
概括
我们开发了一种新的理论来量化非平衡热力学中局部平衡近似 (LEA) 的偏差. 我们的研究结果证实,即使在气体混合物的极端度梯度下,LEA仍然准确.
科学领域:
- 非平衡的热力学.
- 动力学理论 动力学理论
- 统计力学就是统计力学.
背景情况:
- 局部平衡近似 (LEA) 在非平衡热力学中对于质量,能量和动量传输至关重要.
- 评估LEA的有效性是很困难的,因为对非平衡状态的表征工具有限.
研究的目的:
- 开发一个理论框架来量化LEA的偏差.
- 为分析超出LEA.的非平衡状态提供工具.
- 在具有挑战性的条件下验证开发的理论并评估LEA准确性.
主要方法:
- 使用动力理论开发了电报方程的非线性延伸.
- 导出了结合热能约束的稳定状态扩散方程.
- 在具有相同成分特性的两组气体混合物上进行分子动力学模拟.
主要成果:
- 开发的理论使得从局部平衡偏差的系统量化.
- 导出了一个稳态扩散方程,考虑了扩散流量上的热能约束.
- 分子动力学模拟证实了LEA的准确性,即使在极端度梯度下.
结论:
- 新的动力学理论为分析非平衡系统提供了可靠的方法.
- 对于气体混合物的扩散过程,即使有显著的度梯度,LEA仍然是一个有效的假设.
- 开发的框架进一步描述了非平衡状态的特征.
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