arXiv subjects

Shucheng Pan

Publications and source records attributed to Shucheng Pan.

At least 19 recordsLinked to original sources

arXiv2026

A conservative coupling method of sharp-interface and multi-species model for compressible reacting gas-liquid flows with phase change

In this paper, a conservative sharp-interface and diffuse-interface coupling method is developed for compressible two-phase multi-species flows with phase change and chemical reactions. The liquid--gas interface is represented by a sharp-interface model, whereas a diffuse-interface model treats the transport and chemical reactions of gas-phase species. Conservation is enforced by coupling the two phases through interfacial fluxes obtained from a multi-species phase-change Riemann problem. The original single-species four-wave Riemann solver is extended to multi-species gas mixtures by modifying the interfacial energy jump condition. Interfacial mass transfer is restricted to the condensable vapor species. Accordingly, both the interfacial energy jump condition and the gas-mixture energy-exchange flux are constructed using the internal energy of the phase-changing vapor species rather than the mixture internal energy. With this species-selective energy coupling, an approximate multi-species Riemann solver is constructed that retains the four-wave structure while avoiding the multidimensional nonlinear root-finding required by the exact solution. A series of numerical tests, including impulsive evaporation and condensation, reacting aluminum vaporization, shock-droplet interaction, and detonation-droplet interaction, are performed to assess the accuracy and robustness of the method. The numerical results agree well with reference solutions and benchmark data, demonstrating that the present method resolves the effects of phase change and chemical reactions in compressible multi-species multiphase flows while preserving conservative interfacial coupling.

physics.flu-dyn↗

arXiv2024

An implicit coupling framework for numerical simulations between hypersonic nonequilibrium flows and charring material thermal response in the presence of ablation

An implicit coupling framework between hypersonic nonequilibrium flows and material thermal response is proposed for the numerical simulation of ablative thermal protection materials during its flight trajectory. Charring ablative materials, when subjected to aerodynamic heating from hypersonic flows, undergo complex processes such as ablation and pyrolysis, involving heterogeneous and homogeneous chemical reactions. These multi-physical phenomena are simulated by a multicomponent material thermal response (MTR) solver that takes into account the complexity of component of pyrolysis gases. The species concentrations are calculated to improve the accuracy of transport and thermophysical parameters of pyrolysis gases. The MTR solver implements implicit time integration on finite difference discretization form to achieve higher efficiency. The numerical solutions of hypersonic flows and material thermal response are coupled through a gas-surface interaction interface based on surface mass and energy balance on the ablating surface. The coupled simulation employs the dual time-step technique, which introduces pseudo time step to improve temporal accuracy. The explicit coupling mechanism updates the interfacial quantities at physical time steps, which achieves higher computational efficiency, but introduces time discretization errors and numerical oscillations of interfacial quantities. In contrast, the implicit coupling mechanism updates the interfacial quantities at pseudo time steps, which reduces the temporal discretization error and suppresses numerical oscillations, but is less efficient. In addition, a simplified ablation boundary based on steady-state ablation assumption or radiation-equilibrium assumption is proposed to approximate solid heat conduction without coupling the MTR solution, providing quasi-steady flow solutions in the presence of ablation.

physics.flu-dyn↗

arXiv2024

High order compact fully-discrete scheme for hyperbolic conversation laws

Based on the solution formula method, a series of one-step fully-discrete schemes, such as FWENO/Full-WENO has been proposed. Storing the by-products conservative variables at the half points (grid center) and using them as interpolation information to construct high-order schemes, we obtain a new class of one-step compact fully-discrete schemes. The new scheme can be associate with various non-oscillatory strategies. This paper takes state-of-the-art WENO-JS method as an example and proposes a family of compact fully-discrete WENO scheme. Detailed analysis is conducted on accuracy, errors, computational cost, efficiency and their connection with Hermite interpolation. Meanwhile, we design a new entropy flux linearization strategy for Euler equations to enhance its robustness, and also develop a multi-dimensional method for this compact fully-discrete framework. Due to the new scheme is one-step and utilizes stored by-products information for interpolation, it has a significant advantage in efficiency. For one-dimensional Euler equations, compared to the original FWENO, the computational cost only increases by 20-40%, while is approximately one-third of WENO+RK3. For two-dimensional case, a new special dimension-by-dimension strategy is applied. Although there is an additional computing cost, numerical experiments show that the new scheme only needs about 1/10 to 1/13 cost of that for WENO+RK3 when obtaining similar or even better resolution results, indicating that the new scheme is more efficient than semi-discrete schemes based on RK methods.

math.NA↗

arXiv2024

XFLUIDS: A SYCL-based unified cross-architecture heterogeneous simulation solver for compressible reacting flows

We present a cross-architecture high-order heterogeneous Navier-Stokes simulation solver, XFluids, for compressible reacting multicomponent flows on different platforms. The multi-component reacting flows are ubiquitous in many scientific and engineering applications, while their numerical simulations are usually time-consuming to capture the underlying multiscale features. Although heterogeneous accelerated computing is significantly beneficial for large-scale simulations of these flows, effective utilization of various heterogeneous accelerators with different architectures and programming models in the market remains a challenge. To address this, we develop XFluids by SYCL, to perform acceleration directly targeted to different devices, without translating any source code. A variety of optimization techniques have been proposed to increase the computational performance of XFluids, including adaptive range assignment, partial eigensystem reconstruction, hotspot device function optimizations, etc. This solver has been open-sourced, and tested on multiple GPUs from different mainstream vendors, indicating high portability. Through various benchmark cases, the accuracy of XFluids is demonstrated, with approximately no efficiency loss compared to existing GPU programming models, such as CUDA and HIP. In addition, the MPI library is used to extend the solver to multi-GPU platforms, with the GPU-enabled MPI supported. With this, the weak scaling of XFluids for multi-GPU devices is larger than 95% for 1024 GPUs. Finally, we simulate both the inert and reactive multicomponent shock-bubble interaction problems with high-resolution meshes, to investigate the reacting effects on the mixing, vortex stretching, and shape deformation of the bubble evolution.

physics.comp-ph↗

arXiv2024

A component-splitting implicit time integration for multicomponent reacting flows simulations

A component-splitting method is proposed to improve convergence characteristics for implicit time integration of compressible multicomponent reactive flows. The characteristic decomposition of flux jacobian of multicomponent Navier-Stokes equations yields a large sparse eigensystem, presenting challenges of slow convergence and high computational costs for implicit methods. To addresses this issue, the component-splitting method segregates the implicit operator into two parts: one for the flow equations (density/momentum/energy) and the other for the component equations. Each part's implicit operator employs flux-vector splitting based on their respective spectral radii to achieve accelerated convergence. This approach improves the computational efficiency of implicit iteration, mitigating the quadratic increase in time cost with the number of species. Two consistence corrections are developed to reduce the introduced component-splitting error and ensure the numerical consistency of mass fraction. Importantly, the impact of component-splitting method on accuracy is minimal as the residual approaches convergence. The accuracy, efficiency, and robustness of component-splitting method are thoroughly investigated and compared with the coupled implicit scheme through several numerical cases involving thermo-chemical nonequilibrium hypersonic flows. The results demonstrate that the component-splitting method decreases the required number of iteration steps for convergence of residual and wall heat flux, decreases the computation time per iteration step, and diminishes the residual to lower magnitude. The acceleration efficiency is enhanced with increases in CFL number and number of species.

math.NA↗

arXiv2023

Effect of phase change on shock wave and n-dodecane droplet interaction with numerical investigation

In a real propulsion system, shock-droplet interaction is often accompanied by phase change, which has a significant effect on the deformation and fragmentation of the droplet. In this paper, we study the effect of phase change on the n-dodecane droplet propulsion, deformation and fragmentation impacted by shock waves with high-resolution numerical simulations. First, we conduct a comparative study on shock waves and n-dodecane droplets interaction with and without phase change model. The impact of the shock wave changes the pressure and temperature distribution around the droplet, causing the droplet liquefaction on the windward side. With the influence of phase change, the Kelvin-Helmholtz instability (KHI) waves on the windward surface are enhanced, the development of KHI waves on the leeward surface of droplet is inhibited by vaporization. Furthermore, it is found that phase change suppresses both the flattening of the cylinder and shearing of the sheet at droplet equator. Next, we investigate the effect of Mach number on shock-droplet interaction with consideration of phase change. As the shock Mach number increases, the flattening and vaporization of droplets are suppressed, the KHI waves on the windward surface and the shear stripping of the sheet at the droplet equator are enhanced. The shear stripping of the liquid sheet plays a more dominant role in the deformation and breakup process than the flattening of the droplet under the SIE breakup mechanism in a higher Mach number.

physics.flu-dyn↗

arXiv2023

An adaptive multiresolution flux reconstruction method with local time stepping and artificial viscosity for compressible flows simulations

In this paper, we introduce a novel approach that combines multiresolution (MR) techniques with the flux reconstruction (FR) method to accurately and effciently simulate compressible flows. We achieve further enhancements in effciency through the incorporation of local time stepping, and we add artificial viscosity to capture shocks. With the developed MR-FR algorithm, the layer difference of two adjacent elements can exceed 1, and simulation errors can be adjusted by manipulating a single scalar. To ensure conservation, information communication between nodes at different layers is accomplished using L2 projection. Additionally, we propose an innovative indicator based on MR analysis to detect discontinuities, enabling us to take full advantage of the details generated by MR. By indicating smoothness and adding artificial viscosity only to the finest meshes, computational costs can be reduced and errors resulting from artificial diffusion can be locally limited. Numerical tests demonstrate that the adoption of MR preserve the convergence order of the FR method, and the newly proposed indicator performs well in detecting discontinuities. Overall, the MR-FR algorithm can accurately simulate compressible flows with strong shocks and physical dissipation using significantly fewer grids, making it a promising approach for further applications.

physics.flu-dyn↗

arXiv2022

Finite volume based film flow and ice accretion models on aircraft wings

The thin runback water films driven by the gas flow, the pressure gradient and the gravity on the iced aircraft surface are investigated in this paper. A three-dimensional film flow model based on Finite Volume Method (FVM) and the lubrication theory is proposed to describe the flow. The depth-averaged velocity of the film is stored in Cartesian coordinates to avoid the appearance of the metric tensors. The governing equations are discretized in the first layer structured grid cell which is selected as the grids for film flow. In order to verify this method, comparisons between numerical results and experimental results of ice shapes on NACA 0012 airfoil and GLC-305 swept wing are presented, both showing a good agreement for rime and glaze ice condition. Overall, this model shows great potential to model ice accretion reasonably under different icing conditions. Besides, the present method doesn't require analytic metric terms, and can be easily coupled to existing finite volume solvers for logically Cartesian meshes.

physics.flu-dyn↗

arXiv2022

A conservative level-set method based on a posterior mass correction preserving distance property for incompressible multiphase flows simulations

As one of the most popular interface-capturing methods, the level-set method is inherently non-conservative, and its evolution usually leads to unphysical mass gain/loss. In this paper, a novel conservative level set method is developed for incompressible multiphase flows simulations. A posterior mass correction is performed by introducing a small perturbation to the level-set field, which is solved via the Newton method. Unlike in previous researches, the signed distance property of the level-set function is exactly preserved after the present mass correction. Moreover, this method can be easily generalized from 2D to 3D. The influence for the computational efficiency is slight as the correction does not need to be applied at every time step. Various benchmark cases involving pure interface-evolution problems and multiphase flows problems are considered to validate the present method. For all cases, the accuracy and efficiency of the original method and the present method are quantitatively compared. It is observed that, with negligibly extra cost, the conservation error is reduced to the order of machine accuracy by the present method, which indicates its potential applications in complex multiphase flows simulations.

physics.comp-ph↗

arXiv2021

A fully conservative sharp-interface method for compressible mulitphase flows with phase change

A fully conservative sharp-interface method is developed for multiphase flows with phase change. The coupling between two phases is implemented via introducing the interfacial fluxes, which are obtained by solving a general Riemann problem with phase change. A novel four-wave model is proposed to obtain an approximate Riemann solution, which simplifies the eight-dimensional roo-finding procedure in the exact solver to a sole iteration of the mass flux. Unlike in the previous research, the jump conditions of all waves are imposed strictly in the present approximate Riemann solver so that conservation is guaranteed. Different choices of the fluid states used in the phase change model are compared, and we have shown that the adjacent states of phase interface should be used to ensure numerical consistency. To the authors' knowledge, it has not been reported before in the open literature. With good agreements, various numerical examples are considered to validate the present method by comparing the results against the exact solutions or the previous simulations.

physics.comp-ph↗

arXiv2021

A sufficient condition for free-stream preserving in the nonlinear conservative finite difference schemes on curvilinear grids

In simulations of compressible flows, the conservative finite difference method (FDM) based on the nonlinear upwind schemes, e.g. WENO5, might violate free-stream preserving (FP), due to the loss of the geometric conservation law (GCL) identity when applied on the curvilinear grids. Although some techniques on FP have been proposed previously, no general rule is given for this issue. In this paper, by rearranging the upwind dissipation of the nonlinear schemes as a combination of sub-stencil reconstructions (taking WENO5 as an example), it can be proved that the upwind dissipation diminishes under the uniform flow condition if the metrics yield an identical value under the same schemes with these reconstructions, making the free-stream condition be preserved. According to this sufficient condition, the novel FP metrics are constructed for WENO5 and WENO7. By this means the original forms of these WENO schemes can be kept. In addition, the accuracy of these schemes can be retained as well with a simple accuracy compensation by replacing the central part fluxes with a high-order one. Various validations indicate that the present FP schemes retain the great capability to resolve the smooth regions accurately and capture the discontinuities robustly.

physics.comp-ph↗

arXiv2021

Reformulated dissipation for the free-stream preserving of the conservative finite difference schemes on curvilinear grids

In this paper, we develop a new free-stream preserving (FP) method for high-order upwind conservative finite-difference (FD) schemes on the curvilinear grids. This FP method is constrcuted by subtracting a reference cell-face flow state from each cell-center value in the local stencil of the original upwind conservative FD schemes, which effectively leads to a reformulated dissipation. It is convenient to implement this method, as it does not require to modify the original forms of the upwind schemes. In addition, the proposed method removes the constraint in the traditional FP conservative FD schemes that require a consistent discretization of the mesh metrics and the fluxes. With this, the proposed method is more flexible in simulating the engineering problems which usually require a low-order scheme for their low-quality mesh, while the high-order schemes can be applied to approximate the flow states to improve the resolution. After demonstrating the strict FP property and the order of accuracy by two simple test cases, we consider various validation cases, including the supersonic flow around the cylinder, the subsonic flow past the three-element airfoil, and the transonic flow around the ONERA M6 wing, etc., to show that the method is suitable for a wide range of fluid dynamic problems containing complex geometries. Moreover, these test cases also indicate that the discretization order of the metrics have no significant influences on the numerical results if the mesh resolution is not sufficiently large.

math.NA↗

arXiv2019

An accelerated sharp-interface method for multiphase flows simulations

In this work, we develop an accelerated sharp-interface method based on (Hu et al., JCP, 2006) and (Luo et al., JCP, 2015) for multiphase flows simulations. Traditional multiphase simulation methods use the minimum time step of all fluids obtained according to CFL conditions to evolve the fluid states, which limits the computational efficiency, as the sound speed c of one fluid may be much larger than the others. To address this issue, based on the original GFM-like sharp interface methods, the present method is developed by solving the governing equations of each individual fluid with the corresponding time step. Without violating the numerical stability requirement, the states of fluid with larger time-scale features will be updated with a larger time step. The interaction step between two fluids is solved for synchronization, which is handled by interpolating the intermediate states of fluid with larger time-scale features. In addition, an interfacial flux correction is implemented to maintain the conservative property. The present method can be combined with a wavelet-based adaptive multi-resolution algorithm (Han et al., JCP, 2014) to achieve additional computational efficiency. A number of numerical tests indicate that the accuracy of the results obtained by the present method is comparable to the original costly method, with a significant speedup.

physics.comp-ph↗

arXiv2018

A species-clustered ODE solver for large-scale chemical kinetics using detailed mechanisms

In this study, a species-clustered ordinary differential equations (ODE) solver for chemical kinetics with large detailed mechanisms based on operator-splitting is presented. The ODE system is split into clusters of species by using graph partition methods which has been intensively studied in areas of model reduction, parameterization and coarse-graining, etc. , such as diffusion maps based on the concept of Markov random walk. Definition of the weight (similarity) matrix is application-driven and according to chemical kinetics. Each cluster of species is then integrated by VODE, an implicit solver which is intractable and costly for large systems of many species and reactions. Expected speedup in computational efficiency is observed by numerical experiments on three zero-dimensional (0D) auto-ignition problems, considering the detailed hydrocarbon/air combustion mechanisms in varying scales, from 53 species with 325 reactions of methane to 2115 species with 8157 reactions of n-hexadecane.

physics.comp-ph↗

arXiv2018

A Split Random Time Stepping Method for Stiff and Non-stiff Chemically Reacting Flows

In this paper, a new fractional step method is proposed for simulating stiff and nonstiff chemically reacting flows. In stiff cases, a well-known spurious numerical phenomenon, i.e. the incorrect propagation speed of discontinuities, may be produced by general fractional step methods due to the under-resolved discretization in both space and time. The previous random projection method has been successfully applied for stiff detonation capturing in under-resolved conditions. Not to randomly project the intermediate state into two presumed equilibrium states (completely burnt or unburnt) as in the random projection method, the present study is to randomly choose the time-dependent advance or stop of a reaction process. Each one-way reaction has been decoupled from the multi-reaction kinetics using operator splitting and the local smeared temperature due to numerical dissipation of shock-capturing schemes is compared with a random one within two limited temperatures corresponding to the advance and its inverse states, respectively, to control the random reaction. The random activation or deactivation in the reaction step is thus promising to correct the deterministic accumulative error of the propagation of discontinuities. Extensive numerical experiments, including model problems and realistic reacting flows in one and two dimensions, demonstrate this expectation as well as the effectiveness and robustness of the method. Meanwhile, for nonstiff problems when spatial and temporal resolutions are fine, the proposed random method recovers the results as general fractional step methods, owing to the increasing possibility of activation with diminishing randomness by adding a shift term.

physics.comp-ph↗

arXiv2018

A network partition method for solving large-scale complex nonlinear processes

A numerical framework based on network partition and operator splitting is developed to solve nonlinear differential equations of large-scale dynamic processes encountered in physics, chemistry and biology. Under the assumption that those dynamic processes can be characterized by sparse networks, we minimize the number of splitting for constructing subproblems by network partition. Then the numerical simulation of the original system is simplified by solving a small number of subproblems, with each containing uncorrelated elementary processes. In this way, numerical difficulties of conventional methods encountered in large-scale systems such as numerical instability, negative solutions, and convergence issue are avoided. In addition, parallel simulations for each subproblem can be achieved, which is beneficial for large-scale systems. Examples with complex underlying nonlinear processes, including chemical reactions and reaction-diffusion on networks, demonstrate that this method generates convergent solution in a efficient and robust way.

physics.comp-ph↗

arXiv2018

A variational-level-set based partitioning method for block-structured meshes

We propose a numerical method for solving block-structured mesh partitioning problems based on the variational level-set method of (Zhao et al., J Comput Phys 127, 1996) which has been widely used in many partitioning problems such as image segmentation and shape optimization. Here, the variational model and its level-set formulation have been simplified that only one single level-set function is evolved. Thus, the numerical implementation becomes simple, and the computational and memory overhead are significantly alleviated, making this method suitable for solving realistic block-structured mesh partitioning problems where a large number of regions is required. We start to verify this method by a range of two-dimensional and three-dimensional uniform mesh partitioning cases. The results agree with the theoretical solutions very well and converge rapidly. More complex cases, including block-structured adaptive mesh partitioning for single-phase and multi-phase multi-resolution simulations, confirm the accuracy, robustness and good convergence property. The measured CPU time shows that this method is efficient for both two-dimensional and three-dimensional realistic partitioning problems in parallel computing. The proposed method has the potential to be extended to solve other partitioning problems by replacing the energy functional.

physics.comp-ph↗

arXiv2017

A conservative sharp-interface method for compressible multi-material flows

In this paper we develop a conservative sharp-interface method dedicated to simulating multiple compressible fluids. Numerical treatments for a cut cell shared by more than two materials are proposed. First, we simplify the interface interaction inside such a cell with a reduced model to avoid explicit interface reconstruction and complex flux calculation. Second, conservation is strictly preserved by an efficient conservation correction procedure for the cut cell. To improve the robustness, a multi-material scale separation model is developed to consistently remove non-resolved interface scales. In addition, the multi-resolution method and local time-stepping scheme are incorporated into the proposed multi-material method to speed up the high-resolution simulations. Various numerical test cases, including the multi-material shock tube problem, inertial confinement fusion implosion, triple-point shock interaction and shock interaction with multi-material bubbles, show that the method is suitable for a wide range of complex compressible multi-material flows.

physics.comp-ph↗