非线性体变形和大剪切应变对一阶相变动力学的控制

IF 1.9 4区 工程技术 Q3 MECHANICS Continuum Mechanics and Thermodynamics Pub Date : 2023-07-16 DOI:10.1007/s00161-023-01245-5
Ivan Utkin, Liudmila Khakimova, Stefan Markus Schmalholz, Yury Podladchikov
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引用次数: 0

摘要

相变在众多耦合自然过程中起着关键作用,对许多工业应用也很重要。然而,仍需更好地量化发生大机械变形的耦合化学机械系统中的相变动力学。在此,我们采用扩散界面方法研究了两相二元混合物的相变动力学。我们将卡恩-希利亚德(Cahn-Hilliard)型模型与可压缩粘性流的力学模型相结合。体积可压缩性是压力的非线性函数,剪切粘度是浓度的非线性函数。机械耦合是通过在吉布斯能量方程中采用与压力相关的机械混合项来实现的。我们推导出一个无量纲方程组,并采用保守有限差分离散化的伪瞬态方法对其进行数值求解。考虑到远场简单剪切和纯剪切,我们在一维和二维模型设置中进行了数值模拟。对于化学-机械耦合系统,我们表明相界速度是可代谢程度的线性函数,从而证实了 "正常增长 "的假设。机械耦合越强,化学反应的体积效应越大,相界速度就越低。二维结果表明,机械耦合和远场变形对相变的取向和动力学有显著影响。在二维远场简单剪切和纯剪切条件下,相变产生弦状图案。这些图案的取向由施加的远场变形控制,简单剪切和纯剪切的取向相差 45 度。
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Control of nonlinear bulk deformation and large shear strain on first-order phase transformation kinetics

Phase transformations play a key role in numerous coupled natural processes, and they are important for many industrial applications. However, the kinetics of phase transformations in coupled chemo-mechanical systems undergoing large mechanical deformations still needs to be better quantified. Here, we study the phase transformation kinetics of a two-phase binary mixture using the diffuse interface approach. We couple a Cahn–Hilliard type model with a mechanical model for a compressible viscous flow. The bulk compressibility is a nonlinear function of the pressure, and the shear viscosity is a nonlinear function of the concentration. The mechanical coupling is achieved by employing a pressure-dependent mechanical mixing term in the equation for the Gibbs energy. We derive a dimensionless system of equations which we solve numerically with a pseudo-transient method using conservative finite differences for discretization. We perform numerical simulations in 1D and 2D model setups considering far-field simple shear and pure shear. For a chemo-mechanically coupled system, we show that the velocity of the phase boundary is a linear function of the degree of metastability and, hence, confirm the hypothesis of “normal growth.” A stronger mechanical coupling and a larger volumetric effect of the chemical reaction result in lower phase boundary velocities. The 2D results show a significant impact of the mechanical coupling and the far-field deformation on the orientation and kinetics of the phase transformations. Under far-field simple shear and pure shear in 2D, the phase transformations generate string-like patterns. The orientation of these patterns is controlled by the applied far-field deformation and orientations differ by 45 degrees between simple shear and pure shear.

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来源期刊
CiteScore
5.30
自引率
15.40%
发文量
92
审稿时长
>12 weeks
期刊介绍: This interdisciplinary journal provides a forum for presenting new ideas in continuum and quasi-continuum modeling of systems with a large number of degrees of freedom and sufficient complexity to require thermodynamic closure. Major emphasis is placed on papers attempting to bridge the gap between discrete and continuum approaches as well as micro- and macro-scales, by means of homogenization, statistical averaging and other mathematical tools aimed at the judicial elimination of small time and length scales. The journal is particularly interested in contributions focusing on a simultaneous description of complex systems at several disparate scales. Papers presenting and explaining new experimental findings are highly encouraged. The journal welcomes numerical studies aimed at understanding the physical nature of the phenomena. Potential subjects range from boiling and turbulence to plasticity and earthquakes. Studies of fluids and solids with nonlinear and non-local interactions, multiple fields and multi-scale responses, nontrivial dissipative properties and complex dynamics are expected to have a strong presence in the pages of the journal. An incomplete list of featured topics includes: active solids and liquids, nano-scale effects and molecular structure of materials, singularities in fluid and solid mechanics, polymers, elastomers and liquid crystals, rheology, cavitation and fracture, hysteresis and friction, mechanics of solid and liquid phase transformations, composite, porous and granular media, scaling in statics and dynamics, large scale processes and geomechanics, stochastic aspects of mechanics. The journal would also like to attract papers addressing the very foundations of thermodynamics and kinetics of continuum processes. Of special interest are contributions to the emerging areas of biophysics and biomechanics of cells, bones and tissues leading to new continuum and thermodynamical models.
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