Kinetics of vapor–liquid and vapor–solid phase separation under gravity

IF 2.8 3区 化学 Q3 CHEMISTRY, PHYSICAL
Soft Matter Pub Date : 2025-01-06 DOI:10.1039/D4SM01055H
Daniya Davis and Bhaskar Sen Gupta
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Abstract

We study the kinetics of vapor–liquid and vapor–solid phase separation of a hydrodynamics preserving three-dimensional one-component Lennard Jones system in the presence of an external gravitational field using extensive molecular dynamic simulation. A bicontinuous domain structure is formed when the homogeneous system near the critical density is quenched inside the coexistence region. In the absence of gravity, the domain morphology is statistically self-similar and the length scale grows as per the existing laws. However, the presence of gravity destroys the isotropy of the system and affects the scaling laws. We observe an accelerated domain growth in the direction of the field which resembles a sedimentation process. Consequently, a new length scale emerges which strongly depends on the field strength. Similar behavior is observed in the direction perpendicular to the applied field, with a different growth rate. Finally, the statistical self-similarity of the domain growth and the Porod law in such anisotropic systems is verified in terms of two-point equal time order parameter correlation function and static structure factor.

Abstract Image

重力作用下气液和气固相分离动力学。
我们利用广泛的分子动力学模拟,研究了在外部引力场作用下,保持流体力学的三维单组分伦纳德-琼斯体系的汽液相分离和汽固相分离动力学。当临界密度附近的均相体系在共存区内淬火时,会形成一个双连续域结构。在没有引力的情况下,畴形态在统计上是自相似的,长度尺度按照现有规律增长。然而,引力的存在破坏了系统的各向同性,影响了缩放规律。我们观察到畴体沿着场的方向加速生长,这类似于沉积过程。因此,出现了一种新的长度尺度,它与场强密切相关。在垂直于外加磁场的方向上,也观察到类似的行为,但增长速度不同。最后,从两点等时阶参数相关函数和静态结构因子的角度验证了这种各向异性系统中域生长的统计自相似性和 Porod 规律。
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来源期刊
Soft Matter
Soft Matter 工程技术-材料科学:综合
CiteScore
6.00
自引率
5.90%
发文量
891
审稿时长
1.9 months
期刊介绍: Soft Matter is an international journal published by the Royal Society of Chemistry using Engineering-Materials Science: A Synthesis as its research focus. It publishes original research articles, review articles, and synthesis articles related to this field, reporting the latest discoveries in the relevant theoretical, practical, and applied disciplines in a timely manner, and aims to promote the rapid exchange of scientific information in this subject area. The journal is an open access journal. The journal is an open access journal and has not been placed on the alert list in the last three years.
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