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Numerical investigation of a new class of models of Darcy-scale flows with flow-dependent permeability 对具有随流渗透性的达西尺度流动新型模型的数值研究
IF 3.8 2区 物理与天体物理 Q2 COMPUTER SCIENCE, INTERDISCIPLINARY APPLICATIONS Pub Date : 2024-11-22 DOI: 10.1016/j.jcp.2024.113604
Alexander A. Belozerov, Natalia B. Petrovskaya, Yulii D. Shikhmurzaev
The Darcy model for flows in porous media is hugely popular among researchers and practitioners yet there are many problems where the classical Darcy model is not efficient and accurate as it gives rise to manifestly nonphysical singularities. We aim to investigate numerically a new class of mathematical models that allow for handling nonphysical singularities while preserving the advantages of the classical Darcy model. The introduced dependence of the permeability of the porous matrix on the flow that passes through it makes it necessary to compute the flow field and the permeability field simultaneously, and we therefore develop a novel numerical method to compute the solution to a strongly nonlinear system of PDEs arising in the problem. Our approach allows one to take characteristics of the flow geometry into account in numerical solution and we demonstrate the predictive potential of the generalized Darcy model through numerical tests.
多孔介质中流动的达西模型深受研究人员和从业人员的欢迎,但在许多问题上,经典达西模型并不高效和准确,因为它会产生明显的非物理奇点。我们的目标是对一类新的数学模型进行数值研究,在保留经典达西模型优点的同时,处理非物理奇点。由于多孔基质的渗透率与流经基质的水流有关,因此有必要同时计算流场和渗透率场,因此我们开发了一种新的数值方法来计算问题中出现的强非线性 PDE 系统的解。我们的方法允许在数值求解中考虑流动几何形状的特征,并通过数值测试证明了广义达西模型的预测潜力。
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引用次数: 0
A highly parallelized multiscale preconditioner for Darcy flow in high-contrast media 高对比度介质中达西流的高度并行化多尺度预处理程序
IF 3.8 2区 物理与天体物理 Q2 COMPUTER SCIENCE, INTERDISCIPLINARY APPLICATIONS Pub Date : 2024-11-22 DOI: 10.1016/j.jcp.2024.113603
Changqing Ye , Shubin Fu , Eric T. Chung , Jizu Huang
In this paper, we develop a highly parallelized preconditioner based on multiscale space to tackle Darcy flow in highly heterogeneous porous media. The crucial component of this preconditioner is devising a sequence of nested subspaces: WLWL1W1=Wh. By defining an appropriate spectral problem within the space of Wi1, we leverage the eigenfunctions of these spectral problems to form Wi. The preconditioner is then employed to solve a positive semidefinite linear system, which arises from discretizing the Darcy flow equation using the lowest order Raviart-Thomas spaces and adopting a trapezoidal quadrature rule. We will present both theoretical analysis and numerical investigations of this preconditioner. In particular, we will explore various highly heterogeneous permeability fields with resolutions of up to 10243, evaluating the computational performance of the preconditioner in several aspects, including strong scalability, weak scalability, and robustness against the contrast ratio of the media. In high-contrast settings, the proposed preconditioner demonstrates superior performance in terms of stability and efficiency compared to the default algebraic multigrid solver in PETSc, a renowned high performance computing library. A numerical experiment will showcase the preconditioner's capability to solve a high-contrast, large-scale problem with 10243 degrees of freedom using just 1728 CPU cores with 30 seconds. Furthermore, we will demonstrate the application of this preconditioner in solving benchmark problems related to two-phase flow.
在本文中,我们开发了一种基于多尺度空间的高度并行化预处理程序,用于处理高度异质多孔介质中的达西流。该预处理程序的关键部分是设计一系列嵌套子空间:WL⊂WL-1⊂...⊂W1=Wh。通过在 Wi-1 空间内定义适当的谱问题,我们利用这些谱问题的特征函数形成 Wi。然后利用预处理器求解正半有限线性系统,该系统是通过使用最低阶拉维亚特-托马斯空间并采用梯形正交规则对达西流方程进行离散化而产生的。我们将介绍该预处理的理论分析和数值研究。特别是,我们将探索分辨率高达 10243 的各种高度异质渗透场,从几个方面评估预处理的计算性能,包括强可扩展性、弱可扩展性以及对介质对比度的鲁棒性。在高对比度环境下,与著名的高性能计算库 PETSc 中的默认代数多网格求解器相比,所提出的预处理器在稳定性和效率方面都表现出更优越的性能。通过数值实验,我们将展示该预条件器仅用 1728 个 CPU 内核就能在 30 秒内解决 10243 个自由度的高对比度大规模问题的能力。此外,我们还将展示该预处理程序在解决与两相流相关的基准问题中的应用。
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引用次数: 0
A FFT-based phase-field framework for simulating dendritic growth in binary alloy 模拟二元合金树枝状生长的基于 FFT 的相场框架
IF 3.8 2区 物理与天体物理 Q2 COMPUTER SCIENCE, INTERDISCIPLINARY APPLICATIONS Pub Date : 2024-11-22 DOI: 10.1016/j.jcp.2024.113600
Arijit Sinhababu, Shyamprasad Karagadde
In the present study, a Fourier pseudo-spectral-based, phase-field framework is developed to simulate the binary alloy solidification using fixed grids. The motivation behind this proposition of a new model towards overcoming existing limitations is two-fold: firstly, to create a fully validated high-order phase-field model that closely aligns with LKT predictions of tip kinetics across various undercoolings and compositions, and secondly, to achieve accurate simulations using fixed Cartesian meshes with a grid size of order more than unity. In the Fourier pseudo-spectral method, the nonlinear terms of the PF equations are de-aliased using zero padding and high-order Fourier smoothing exponential filters. Accurate growth kinetics during binary alloy solidification are observed despite employing fixed mesh sizes, even when the ratio of grid size to diffuse interface thickness is 1.42. A hybrid, integrating factor (IF)-based, strongly stable third-order Runge-Kutta method (SSPRK3) is implemented to obtain improved temporal stability at high Lewis numbers. A novel scaling relationship between dimensionless tip velocity and undercooling is obtained from the growth of a four-arm equiaxed dendrite at different levels of undercooling. The growth of several randomly oriented dendrites is also accurately simulated without using any mesh refinement schemes. Likewise, the tip velocity closely matched the LKT predictions at dilute concentrations at the boundary. Furthermore, the effects of the coupling parameter and the anti-trapping term on dendritic growth kinetics are explored. Overall, the proposed FFT-based framework is expected to capture the crystals' global chemical wave features precisely with fewer points per wavelength (PPW) and has the potential to be scaled up for large-scale simulations.
本研究开发了基于傅立叶伪光谱的相场框架,使用固定网格模拟二元合金凝固。提出新模型以克服现有限制的动机有两个方面:首先,建立一个经过充分验证的高阶相场模型,该模型与 LKT 预测的各种欠冷和成分的尖端动力学密切相关;其次,使用网格大小超过一阶的固定笛卡尔网格实现精确模拟。在傅立叶伪谱法中,使用零填充和高阶傅立叶平滑指数滤波器对 PF 方程的非线性项进行去锯齿处理。尽管采用了固定的网格尺寸,甚至当网格尺寸与扩散界面厚度之比为 1.42 时,也能观察到二元合金凝固过程中的精确生长动力学。采用基于积分因子 (IF) 的混合强稳定三阶 Runge-Kutta 方法 (SSPRK3),提高了高 Lewis 数下的时间稳定性。在不同的过冷度下,通过四臂等轴枝晶的生长,获得了无量纲尖端速度与过冷度之间的新型比例关系。在不使用任何网格细化方案的情况下,还精确模拟了多个随机取向树枝状突起的生长。同样,在边界稀释浓度下,顶端速度与 LKT 预测值非常吻合。此外,还探讨了耦合参数和反捕获项对树突生长动力学的影响。总之,所提出的基于 FFT 的框架有望以更少的每波长点数(PPW)精确捕捉晶体的全局化学波特征,并有可能被放大用于大规模模拟。
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引用次数: 0
Numerical path preserving Roe scheme for ideal MHD Riemann problem: Complete elimination of pseudo-convergence 理想MHD Riemann问题的数值保路Roe格式:完全消除伪收敛性
IF 3.8 2区 物理与天体物理 Q2 COMPUTER SCIENCE, INTERDISCIPLINARY APPLICATIONS Pub Date : 2024-11-21 DOI: 10.1016/j.jcp.2024.113621
Ke Xu , Zhenxun Gao , Zhansen Qian , Chongwen Jiang , Chun-Hian Lee
Pseudo-convergence appears when ideal magnetohydrodynamic (MHD) equations are numerically solved, i.e., a converged numerical solution cannot be obtained even by continuously refining the grids under the initial condition of a large angle of the tangential magnetic field. However, the current numerical methods for pseudo-convergence have not explored the intrinsic cause of pseudo-convergence. Therefore, the current numerical schemes cannot completely eliminate the pseudo-convergence phenomenon. In this paper, we first perform an in-depth analysis of pseudo-convergence and find that the essence of pseudo-convergence lies in the unphysical averaging process of the existing numerical schemes for the Alfvénic waves. Based on this finding, the merits of numerical path preserving (NPP) of the Godunov scheme are generalized to correct the eigenvalues, eigenvectors, and wave strength of the Alfvénic field in the MHD Roe scheme, and the novel NPP-Roe scheme is constructed so that the Alfvénic field can be captured correctly. Compared with the traditional Roe scheme, numerical validation shows that NPP-Roe scheme significantly reduces the computational grid requirements for the numerical simulation of the MHD problem and eliminates the pseudo-convergence phenomenon of the MHD problem by directly reducing the absolute error magnitude. In addition, for Riemann problems with tangential symmetry (e.g., 180° Alfvénic wave, Brio & Wu problem), the NPP-Roe scheme is also able to simulate the exact regular solutions that cannot be obtained by the traditional Roe scheme, which indicates that the NPP-Roe scheme expands the application range of the traditional scheme.
理想磁流体动力学(MHD)方程在数值求解时出现伪收敛现象,即在切向磁场角度较大的初始条件下,即使连续细化网格也不能得到收敛的数值解。然而,现有的伪收敛数值方法并没有探究伪收敛的内在原因。因此,目前的数值格式不能完全消除伪收敛现象。本文首先对伪收敛性进行了深入的分析,发现伪收敛性的本质在于现有的alfvsamonic波数值格式的非物理平均过程。在此基础上,推广了Godunov格式数值路径保持(NPP)的优点,修正了MHD Roe格式中alfvsamicic场的特征值、特征向量和波强,构造了新的NPP-Roe格式,使alfvsamicic场能够被正确捕获。数值验证表明,与传统的Roe方案相比,NPP-Roe方案显著降低了MHD问题数值模拟的计算网格要求,并通过直接减小绝对误差量级消除了MHD问题的伪收敛现象。此外,对于切向对称的Riemann问题(如180°alfvsamicic波),Brio &;同时,NPP-Roe方案还能模拟出传统Roe方案无法得到的精确正则解,这表明NPP-Roe方案拓展了传统方案的应用范围。
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引用次数: 0
High order accurate Hermite schemes on curvilinear grids with compatibility boundary conditions 具有兼容性边界条件的曲线网格上的高阶精确赫米特方案
IF 3.8 2区 物理与天体物理 Q2 COMPUTER SCIENCE, INTERDISCIPLINARY APPLICATIONS Pub Date : 2024-11-21 DOI: 10.1016/j.jcp.2024.113597
Allen Alvarez Loya , Daniel Appelö , William D. Henshaw
High order accurate Hermite methods for the wave equation on curvilinear domains are presented. Boundaries are treated using centered compatibility conditions rather than more standard one-sided approximations. Both first-order-in-time (FOT) and second-order-in-time (SOT) Hermite schemes are developed. Hermite methods use the solution and multiple derivatives as unknowns and achieve space-time orders of accuracy 2m1 (FOT) and 2m (SOT) for methods using (m+1)d degree of freedom per node in d dimensions. The compatibility boundary conditions (CBCs) are based on taking time derivatives of the boundary conditions and using the governing equations to replace the time derivatives with spatial derivatives. These resulting constraint equations augment the Hermite scheme on the boundary. The solvability of the equations resulting from the compatibility conditions is analyzed. Numerical examples demonstrate the accuracy and stability of the new schemes in two dimensions.
介绍了曲线域上波浪方程的高阶精确赫米特方法。在处理边界时,使用了居中相容条件,而不是更标准的单边近似。同时开发了一阶在时 (FOT) 和二阶在时 (SOT) Hermite 方案。赫米特方法使用解和多重导数作为未知数,在 d 维中使用 (m+1)d 个自由度的每个节点的方法中,达到 2m-1 (FOT) 和 2m (SOT) 的时空精度阶数。兼容性边界条件 (CBC) 基于边界条件的时间导数,并使用控制方程将时间导数替换为空间导数。由此产生的约束方程增强了边界上的 Hermite 方案。分析了相容条件所产生的方程的可解性。数值示例证明了新方案在二维领域的准确性和稳定性。
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引用次数: 0
Auxiliary relaxation method to derive thermodynamically consistent phase field models with constraints and structure preserving numerical approximations 辅助松弛法导出具有约束和保持结构的数值近似的热力学一致相场模型
IF 3.8 2区 物理与天体物理 Q2 COMPUTER SCIENCE, INTERDISCIPLINARY APPLICATIONS Pub Date : 2024-11-20 DOI: 10.1016/j.jcp.2024.113598
Qi Hong , Zengyan Zhang , Jia Zhao
In this paper, we introduce a novel approach for formulating phase field models with constraints. The main idea is to introduce auxiliary variables that regularize and gradually dissipate constraint deviations of the phase variables, which we name the auxiliary relaxation method. It integrates seamlessly with the energy variational framework to ensure thermodynamic consistency in the resulting phase field models. Unlike traditional penalty methods, which introduce high stiffness due to large penalty parameters to enforce constraints in phase field models, our approach reduces system stiffness, allowing larger time step sizes when solving phase field models with constraints numerically, thus improving numerical accuracy and efficiency. We demonstrate the effectiveness and robustness of the proposed auxiliary relaxation method by applying it across several scenarios to derive thermodynamically consistent phase field models with constraints. Furthermore, we introduce a general second-order implicit-explicit Crank-Nicolson scheme, combining the relaxed scalar auxiliary variable method with a stabilization technique to solve these models. Through extensive numerical tests, we validate the capability of our modeling and numerical framework to reliably simulate complex dynamics governed by phase field equations with constraints.
本文提出了一种新的带约束相场模型的构造方法。主要思想是引入辅助变量,使相变量的约束偏差正则化并逐渐消散,我们称之为辅助松弛法。它与能量变分框架无缝集成,以确保所得相场模型的热力学一致性。与传统的惩罚方法不同,传统的惩罚方法由于大的惩罚参数而引入高刚度来强制相场模型中的约束,我们的方法降低了系统刚度,允许更大的时间步长在数值上求解具有约束的相场模型,从而提高了数值精度和效率。我们通过将所提出的辅助松弛方法应用于几种情况来推导具有约束的热力学一致相场模型,从而证明了该方法的有效性和鲁棒性。在此基础上,结合松弛标量辅助变量法和稳定化技术,提出了一种广义的二阶隐式-显式Crank-Nicolson格式。通过大量的数值试验,我们验证了我们的建模和数值框架能够可靠地模拟具有约束的相场方程控制的复杂动力学。
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引用次数: 0
Stability evaluation of approximate Riemann solvers using the direct Lyapunov method 利用直接李雅普诺夫法评估近似黎曼求解器的稳定性
IF 3.8 2区 物理与天体物理 Q2 COMPUTER SCIENCE, INTERDISCIPLINARY APPLICATIONS Pub Date : 2024-11-20 DOI: 10.1016/j.jcp.2024.113599
A. Gogoi , J.C. Mandal , A. Saraf
The paper presents a new approach of stability evaluation of the approximate Riemann solvers based on the direct Lyapunov method. The present methodology offers a detailed understanding of the origins of numerical shock instability in approximate Riemann solvers. The pressure perturbation feeding the density and transverse momentum perturbations is identified as the cause of the numerical shock instabilities in the complete approximate Riemann solvers, while the magnitude of the numerical shock instabilities is found to be proportional to the magnitude of the pressure perturbations. A shock-stable HLLEM scheme is proposed based on the insights obtained from this analysis about the origins of numerical shock instability in the approximate Riemann solvers. A set of numerical test cases are solved to show that the proposed scheme is free from numerical shock instability problems of the original HLLEM scheme at high Mach numbers.
本文提出了一种基于直接李亚普诺夫方法的近似黎曼求解器稳定性评估新方法。本方法提供了对近似黎曼求解器中数值冲击不稳定性起源的详细理解。在完整的近似黎曼求解器中,馈入密度和横动量扰动的压力扰动被确定为数值冲击不稳定性的原因,同时发现数值冲击不稳定性的大小与压力扰动的大小成正比。根据对近似黎曼求解器中数值冲击不稳定性根源的分析,提出了一种冲击稳定的 HLLEM 方案。通过对一组数值测试案例的求解,表明所提出的方案在高马赫数下不存在原始 HLLEM 方案的数值冲击不稳定性问题。
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引用次数: 0
Resolution invariant deep operator network for PDEs with complex geometries 针对具有复杂几何特征的 PDE 的分辨率不变深度算子网络
IF 3.8 2区 物理与天体物理 Q2 COMPUTER SCIENCE, INTERDISCIPLINARY APPLICATIONS Pub Date : 2024-11-20 DOI: 10.1016/j.jcp.2024.113601
Jianguo Huang , Yue Qiu
Neural operators (NO) are discretization invariant deep learning methods with functional output and can approximate any continuous operator. NO has demonstrated the superiority of solving partial differential equations (PDEs) over other deep learning methods. However, for the widely used Fourier neural operator (FNO), the spatial domain of its input function needs to be identical to its output, i.e., FNO fails to approximate the map from boundary conditions to PDE solutions, which limits its applicability. To address this issue, we propose a novel framework called resolution-invariant deep operator (RDO) that decouples the spatial domain of the input and output. RDO is motivated by the Deep operator network (DeepONet) and it does not require retraining the network when the input/output is changed compared with DeepONet. RDO takes functional input and its output is also functional so that it keeps the resolution invariant property of NO. It can also resolve PDEs with complex geometries whereas FNO fails. Various numerical experiments demonstrate the advantage of our method over DeepONet and FNO.
神经算子(NO)是具有函数输出的离散不变深度学习方法,可以近似任何连续算子。与其他深度学习方法相比,神经算子在求解偏微分方程(PDE)方面表现出优越性。然而,对于广泛使用的傅立叶神经算子(FNO)来说,其输入函数的空间域需要与输出相同,即 FNO 无法近似从边界条件到 PDE 解的映射,这限制了其适用性。为了解决这个问题,我们提出了一种名为 "分辨率不变深度算子(RDO)"的新框架,它能将输入和输出的空间域分离开来。RDO 受深度算子网络(DeepONet)的启发,与 DeepONet 相比,当输入/输出发生变化时,无需重新训练网络。RDO 采用函数式输入,其输出也是函数式的,因此保持了 NO 的解析不变性。它还能解析具有复杂几何形状的 PDE,而 FNO 则无法做到这一点。各种数值实验证明了我们的方法优于 DeepONet 和 FNO。
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引用次数: 0
A hybrid method for insoluble surfactant dynamics 不溶性表面活性剂动力学的混合方法
IF 3.8 2区 物理与天体物理 Q2 COMPUTER SCIENCE, INTERDISCIPLINARY APPLICATIONS Pub Date : 2024-11-20 DOI: 10.1016/j.jcp.2024.113602
Yu Fan , Shuoguo Zhang , Xiaoliang Li , Yujie Zhu , Xiangyu Hu , Nikolaus A. Adams
In this paper, we develop a hybrid method for insoluble surfactant dynamics. While the Navier-Stokes equations are solved by an Eulerian method with level set describing the interfaces, the surfactant transport is tracked by a single-layer Lagrangian particle method. Consequently, this hybrid method inherits the ability in handling topology changes from the level-set method and high computational efficiency from the Eulerian method. On the other hand, the Lagrangian particle method ensures mass conservation and does not require topology information (connectivity). To prevent clustering of Lagrangian particles, a novel remeshing approach is proposed. It not only enables the generation of particle distributions adaptive to interface geometries, especially for extremely large deformation and strong stretching, but also provides an accurate reconstruction of concentration fields on the interface with mass conservation. Furthermore, by proposing an adaptive remeshing control, we optimize the remeshing frequency to balance computational costs and accuracy. Conservation, accuracy, and convergence of the present hybrid method are validated with 2-D and 3-D test cases.
本文提出了一种不溶性表面活性剂动力学的混合方法。Navier-Stokes方程采用欧拉法求解,并用水平集描述界面,而表面活性剂的输运采用单层拉格朗日粒子法跟踪。因此,该混合方法继承了水平集方法处理拓扑变化的能力和欧拉方法的高计算效率。另一方面,拉格朗日粒子法保证了质量守恒,并且不需要拓扑信息(连通性)。为了防止拉格朗日粒子聚类,提出了一种新的拉格朗日粒子重划分方法。它不仅可以生成适应界面几何形状的粒子分布,特别是在极大变形和强拉伸的情况下,而且可以精确地重建具有质量守恒的界面上的浓度场。此外,通过提出自适应重网格控制,我们优化了重网格频率,以平衡计算成本和精度。通过二维和三维实例验证了该混合方法的守恒性、准确性和收敛性。
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引用次数: 0
Rotating flux-tube model for local gyrokinetic simulations with background flow and magnetic shears 带背景流和磁切变的局部陀螺动力学模拟的旋转通量管模型
IF 3.8 2区 物理与天体物理 Q2 COMPUTER SCIENCE, INTERDISCIPLINARY APPLICATIONS Pub Date : 2024-11-19 DOI: 10.1016/j.jcp.2024.113595
Shinya Maeyama , Tomo-Hiko Watanabe , Motoki Nakata , Masanori Nunami , Yuuichi Asahi , Akihiro Ishizawa
We have developed a new computational method called the rotating flux-tube model that treats background shear flows in local gyrokinetic simulations. The method is based on extended magnetohydrodynamic ballooning mode theory. A coordinate transformation moves the flux-tube simulation domain along the sheared magnetic field lines, counteracting the deformation caused by the background shear flow. Linear analyses showed that the rotating flux-tube model describes the time-continuous evolution of fluctuations under shear flow as a single wavenumber mode. The formulation of the rotating flux-tube model makes explicit its mathematical correspondence to the Floquet theory. Nonlinear simulations demonstrated that the rotating flux-tube model can analyze the effects of background shear flow on turbulent transport.
我们开发了一种名为旋转通量管模型的新计算方法,用于处理局部陀螺动能模拟中的背景剪切流。该方法基于扩展的磁流体力学气球模式理论。坐标变换使磁通管模拟域沿剪切磁场线移动,抵消了背景剪切流引起的变形。线性分析表明,旋转磁通管模型将剪切流下波动的时间连续演化描述为单波数模式。旋转通量管模型的表述明确了其与 Floquet 理论的数学对应关系。非线性模拟表明,旋转通量管模型可以分析背景剪切流对湍流传输的影响。
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引用次数: 0
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Journal of Computational Physics
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