跨流域高超声速绕流环境Boltzmann模型方程统一算法研究

如何准确可靠地模拟从外层空间高稀薄流到近地面连续流的航天器高超声速绕流环境与复杂流动变化机理是流体物理的前沿基础科学问题. 基于对Boltzmann方程碰撞积分的物理分析与可计算建模, 确立了可描述自由分子流到连续流区各流域不同马赫数复杂流动输运现象统一的Boltzmann模型速度分布函数方程, 发展了适于高、低不同马赫数绕流问题的离散速度坐标法和直接求解分子速度分布函数演化更新的气体动理论数值格式, 建立了模拟复杂飞行器跨流域高超声速飞行热环境绕流问题的气体动理论统一算法. 对稀薄流到连续流不同Knudsen数0.002 ≤Kn_∞ ≤1.618、不同马赫数下可重复使用卫星体再入过程(110–70 km)中高超声速绕流问题进行算法验证分析, 计算结果与典型文献的Monte Carlo直接模拟值及相关理论分析符合得较好. 研究揭示了飞行器跨流域不同高度高超声速复杂流动机理、绕流现象与气动力/热变化规律, 提出了一个通过数值求解介观Boltzmann模型方程, 可靠模拟高稀薄自由分子流到连续流跨流域高超声速气动力/热绕流特性统一算法.     

Variation character of stagnation point heat flux for hypersonic pointed bodies from continuum to rarefied flow states and its bridge function study

This paper is a research on the variation character of stagnation point heat flux for hypersonic pointed bodies from continuum to rarefied flow states by using theoretical analysis and numerical simulation methods. The newly developed near space hypersonic cruise vehicles have sharp noses and wingtips, which desires exact and relatively simple methods to estimate the stagnation point heat flux. With the decrease of the curvature radius of the leading edge, the flow becomes rarefied gradually, and viscous interaction effects and rarefied gas effects come forth successively, which results in that the classical Fay-Riddell equation under continuum hypothesis will become invalid and the variation of stagnation point heat flux is characterized by a new trend. The heat flux approaches the free molecular flow limit instead of an infinite value when the curvature radius of the leading edge tends to 0. The physical mechanism behind this phenomenon remains in need of theoretical study. Firstly, due to the fact that the whole flow regime can be described by Boltzmann equation, the continuum and rarefied flow are analyzed under a uniform framework. A relationship is established between the molecular collision insufficiency in rarefied flow and the failure of Fourier’s heat conduction law along with the increasing significance of the nonlinear heat flux. Then based on an inspiration drew from Burnett approximation, control factors are grasped and a specific heat flux expression containing the nonlinear term is designed in the stagnation region of hypersonic leading edge. Together with flow pattern analysis, the ratio of nonlinear to linear heat flux W _r is theoretically obtained as a parameter which reflects the influence of nonlinear factors, i.e. a criterion to classify the hypersonic rarefied flows. Ultimately, based on the characteristic parameter W _r , a bridge function with physical background is constructed, which predicts comparative reasonable results in coincidence well with DSMC and experimental data in the whole flow regime.     

稀薄气体流动非线性耦合本构关系研究进展

临近空间高超声速飞行器流场蕴含着复杂的非线性流动机理与丰富的热化学非平衡流动现象, 基于Newton摩擦定律和Fourier热传导定律的Navier-Stokes(N-S)方程不足以描述高超声速飞行器从连续流到稀薄流的多尺度非平衡现象。非线性耦合本构关系(nonlinear coupled constitutive relations, NCCR)作为一种全新的本构方程体系, 在严格满足热力学熵条件的基础上, 巧妙地构建了应力与热流的非线性表达形式。然而, NCCR方程的强非线性耦合特性是求解过程的一大难题。为了克服这一技术瓶颈, 提出了混合迭代算法, 为实现NCCR方程的高效稳定求解提供了坚实的理论基础。在该理论研究的基础上, 考虑到原始NCCR方程对热通量演化方程的简化处理, 降低了方程的计算精度, 提出了改进的NCCR+方程。该方程在强激波压缩区域和膨胀区域表现出比传统NCCR方程更高的计算精度与更强的非平衡流动模拟能力。同时, 为了解决临近空间高超声速空气动力学的多尺度与多物理效应耦合难题, 提出了NCCR与转动非平衡的耦合计算模型, 拓展了NCCR方程在双原子气体中的模拟能力。为了揭示稀薄气体效应与真实气体效应的耦合作用机理, 进一步建立了NCCR与热化学反应的耦合计算方法。大量研究结果表明, 考虑多物理效应的NCCR方程在低Kn下能够恢复到与N-S方程一致的解。随着Kn的增加, 流场的非平衡程度逐渐增强, 其结果与N-S方程差异显著, 而与DSMC方法计算结果和实验数据具有更好的一致性。      

A low diffusion particle method for simulating compressible inviscid flows

A new particle method is presented for the numerical simulation of compressible inviscid gas flows, through procedures which involve relatively small modifications to an existing direct simulation Monte Carlo (DSMC) algorithm. Implementation steps are outlined for simulations involving various grid geometries and for gas mixtures comprising an arbitrary number of species. The proposed method is compared with other numerical schemes through a series of one-dimensional and two-dimensional test cases, and is shown to provide a significant reduction in both artificial diffusion and statistical scatter effects relative to existing DSMC-based equilibrium particle methods.     

Heterogeneous physical and chemical processes in a rarefied-gas flow in channels

A flow with physical and chemical reactions on hot surfaces is investigated. On the basis of physical experiments, determining the hydrogen-dissociation degree in rarefied gas and calculation of the flow by the method of direct simulation Monte Carlo (DSMC), it is possible to specify certain unknown constants of interaction of molecules and atoms with a tungsten surface. By the example of the hydrogen flow in a hightemperature tungsten cylindrical channel, the role of dissociation, sorption, and recombination processes is shown in a wide range of flow regimes from free-molecular to continuum.     

Atomistic hybrid DSMC/NEMD method for nonequilibrium multiscale simulations

A multiscale hybrid method for coupling the direct simulation Monte Carlo (DSMC) method to the nonequilibrium molecular dynamics (NEMD) method is introduced. The method addresses Knudsen layer type gas flows within a few mean free paths of an interface or about an object with dimensions of the order of a few mean free paths. It employs the NEMD method to resolve nanoscale phenomena closest to the interface along with coupled DSMC simulation of the remainder of the Knudsen layer. The hybrid DSMC/NEMD method is a particle based algorithm without a buffer zone. It incorporates a new, modified generalized soft sphere (MGSS) molecular collision model to improve the poor computational efficiency of the traditional generalized soft sphere GSS model and to achieve DSMC compatibility with Lennard-Jones NEMD molecular interactions. An equilibrium gas, a Fourier thermal flow, and an oscillatory Couette flow, are simulated to validate the method. The method shows good agreement with Maxwell–Boltzmann theory for the equilibrium system, Chapman–Enskog theory for Fourier flow, and pure DSMC simulations for oscillatory Couette flow. Speedup in CPU time of the hybrid solver is benchmarked against a pure NEMD solver baseline for different system sizes and solver domain partitions. Finally, the hybrid method is applied to investigate interaction of argon gas with solid surface molecules in a parametric study of the influence of wetting effects and solid molecular mass on energy transfer and thermal accommodation coefficients. It is determined that wetting effect strength and solid molecular mass have a significant impact on the energy transfer between gas and solid phases and thermal accommodation coefficient.     

A unified gas-kinetic scheme for continuum and rarefied flows

With discretized particle velocity space, a multiscale unified gas-kinetic scheme for entire Knudsen number flows is constructed based on the BGK model. The current scheme couples closely the update of macroscopic conservative variables with the update of microscopic gas distribution function within a time step. In comparison with many existing kinetic schemes for the Boltzmann equation, the current method has no difficulty to get accurate Navier–Stokes (NS) solutions in the continuum flow regime with a time step being much larger than the particle collision time. At the same time, the rarefied flow solution, even in the free molecule limit, can be captured accurately. The unified scheme is an extension of the gas-kinetic BGK-NS scheme from the continuum flow to the rarefied regime with the discretization of particle velocity space. The success of the method is due to the un-splitting treatment of the particle transport and collision in the evaluation of local solution of the gas distribution function. For these methods which use operator splitting technique to solve the transport and collision separately, it is usually required that the time step is less than the particle collision time. This constraint basically makes these methods useless in the continuum flow regime, especially in the high Reynolds number flow simulations. Theoretically, once the physical process of particle transport and collision is modeled statistically by the kinetic Boltzmann equation, the transport and collision become continuous operators in space and time, and their numerical discretization should be done consistently. Due to its multiscale nature of the unified scheme, in the update of macroscopic flow variables, the corresponding heat flux can be modified according to any realistic Prandtl number. Subsequently, this modification effects the equilibrium state in the next time level and the update of microscopic distribution function. Therefore, instead of modifying the collision term of the BGK model, such as ES-BGK and BGK–Shakhov, the unified scheme can achieve the same goal on the numerical level directly. Many numerical tests will be used to validate the unified method.     

Simulation of unsteady flows by the DSMC macroscopic chemistry method

In the Direct Simulation Monte-Carlo (DSMC) method, a combination of statistical and deterministic procedures applied to a finite number of ‘simulator’ particles are used to model rarefied gas-kinetic processes. In the macroscopic chemistry method (MCM) for DSMC, chemical reactions are decoupled from the specific particle pairs selected for collisions. Information from all of the particles within a cell, not just those selected for collisions, is used to determine a reaction rate coefficient for that cell. Unlike collision-based methods, MCM can be used with any viscosity or non-reacting collision models and any non-reacting energy exchange models. It can be used to implement any reaction rate formulations, whether these be from experimental or theoretical studies. MCM has been previously validated for steady flow DSMC simulations. Here we show how MCM can be used to model chemical kinetics in DSMC simulations of unsteady flow. Results are compared with a collision-based chemistry procedure for two binary reactions in a 1-D unsteady shock-expansion tube simulation. Close agreement is demonstrated between the two methods for instantaneous, ensemble-averaged profiles of temperature, density and species mole fractions, as well as for the accumulated number of net reactions per cell.     

A unified gas kinetic scheme with moving mesh and velocity space adaptation

There is great difficulty for direct Boltzmann solvers to simulate high Knudsen number flow due to the severe steep slope and high concentration of the gas distribution function in a local particle velocity space. Local mesh adaptation becomes necessary in order to make the Boltzmann solver to be a practical tool in aerospace applications. The present research improves the unified gas-kinetic scheme (UGKS) in the following two aspects. First, the UGKS is extended in a physical space with moving mesh. This technique is important to study a freely flying object in a rarefied environment. Second, the adaptive quadtree method in the particle velocity space is implemented in the UGKS. Due to the new improvements in the discretization of a gas distribution function in the six dimensional phase space, the adaptive unified gas kinetic scheme (AUGKS) is able to deal with a wide range of flow problems under extreme flying conditions, such as the whole unsteady flying process of an object from a highly rarefied to a continuum flow regime. After validating the scheme, the capability of AUGKS is demonstrated in the following two challenge test cases. The first case is about the free movement of an ellipse flying at initial Mach number 5 in a rarefied flow at different Knudsen numbers. The force on the ellipse and the unsteady trajectory of the ellipse movement are fully captured. The gas distribution function around the ellipse is analyzed. The second case is about the study of unsteady flight of a nozzle under a bursting process of the compressed gas expanding into a rarefied environment. Due to the strong expansion wave and the huge density difference between interior and exterior regions around the nozzle, the particle distribution function changes dramatically in the particle velocity space. The use of an adaptive velocity space in the AUGKS becomes necessary to simulate such a flow and to control the computational cost to a tolerable level. The second test is a challenge problem for any existing rarefied flow solver.     

Investigation of hypersonic flows through a cavity with sweepback angle in near space using the DSMC method

Near space has been paid more and more attentionin recent years due to its military application value.However,flow characteristics of some fundamental configurations(e.g.,the cavity) in near space have rarely been investigated due to rarefied gas effects,which make the numerical simulation methods based on continuous flow hypothesis lose validity.In this work,the direct simulation Monte Carlo(DSMC),one of the most successful particle simulation methods in treating rarefied gas dynamics,is employed to explore flow characteristics of a hypersonic cavity with sweepback angle in near space by considering a variety of cases,such as the cavity at a wide range of altitudes 20-60 km,the cavity at freestream Mach numbers of 6-20,and the cavity with a sweepback angle of 30°-90°.By analyzing the simulation results,flow characteristics are obtained and meanwhile some interesting phenomena are also found.The primary recirculation region,which occupies the most area of the cavity,causes pressure and temperature stratification due to rotational motion of fluid inside it,whereas the pressure and temperature in the secondary recirculation region,which is a small vortex and locates at the lower left corner of the cavity,change slightly due to low-speed movement of fluid inside it.With the increase of altitude,both the primary and secondary recirculation regions contract greatly and it causes them to separate.A notable finding is that rotation direction of the secondary recirculation region would be reversed at a higher altitude.The overall effect of increasing the Mach number is that the velocity,pressure,and temperature within the cavity increase uniformly.The maximum pressure nearby the trailing edge of the cavity decreases rapidly as the sweepback angle increases,whereas the influence of sweepback angle on velocity distribution and maximum temperature within the cavity is slight.     

稀薄等离子体稳态流动的数值模拟

为了模拟稀薄等离子体超音速稳态流动,建立了PIC/DSMC混和方法模型.以稳态等离子体推力器(SPT-70)为对象,进行了数值模拟.输入条件来自在真空舱内对SPT-70的实验测量和相关性能计算,数值结果与实验结果的比较表明:本文建立的数学模型和编制的软件是可信的,可以为电推力器性能评价及潜在的羽流污染评估提供有效途径.     

Kinetic Flux–Vector Splitting for the Navier–Stokes Equations

Before a hybrid scheme can be developed combining the direct simulation Monte Carlo (DSMC) method and a Navier–Stokes (NS) representation, one must have access to compatible kinetic-split fluxes from the NS portion of the hybrid scheme. The kinetic theory basis is given for the development of the required fluxes from the Chapman–Enskog velocity distribution function for a simple gas; and these are then extended to a polyatomic gas by use of the Eucken approximation. The derived fluxes are then used to implement boundary conditions at solid surfaces that are based on concepts associated with kinetic theory and the DSMC method. This approach is shown to lead to temperature slip and velocity slip as a natural outcome of the new formulation, a requirement for use in the near-continuum regime where DSMC and NS must be joined. Several different flows, for which solid boundaries are not present, are computed using the derived fluxes, together with a second-order finite-volume scheme, and the results are shown to agree well with several established numerical schemes for the NS equations.     

Development of a coupled NS-DSMC method for the simulation of plume impingement effects of space thrusters

A coupled NS-DSMC method possessing adapted-interface and two-way coupling features is studied to simulate the plume impingement effects of space thrusters. The continuum-rarefied interface is determined by combining Kn_GL and P_tne continuum breakdown parameters. State-based coupling scheme is adopted to transfer information between continuum and particle solvers, and an overlapping grid technique is investigated to combine structured-grid NS code and Cartesian-grid DSMC code to form the coupled solver. Flow problem of a conical thruster plume impinging on a cone surface is simulated using the coupled solver, and the simulation result is compared with experimental data, which proves the validity of the proposed method. Plume flow while the ascent stage of lunar module lifting off in lunar environment is also computed by using the present coupled NS-DSMC method to demonstrate its capability. The whole flow field from combustion chamber to the vacuum environment is obtained, and the result reveals that special attention should be paid to the plume aerodynamic force at the early stage of launching process.     

Variance-reduced DSMC for binary gas flows as defined by the McCormack kinetic model

A variance-reduced direct simulation Monte Carlo method is presented for binary gas flows as defined by the McCormack kinetic model. Two types of flow configuration, namely pressure driven flow between two parallel plates and through rectangular channels, are considered. The kinetic model is transformed into one- and two-dimensional projected formalisms. Both cases are modeled by the variance-reduced DSMC. Simulations are performed to compare the method to the analytical discrete ordinate and discrete velocity methods. For both flow configurations, very good agreement is obtained between the results of different approaches. The results of the approach are also compared to the prediction of the moment method and the results of hard-sphere gases. The model can be beneficial for computing slow rarefied gaseous mixture flows, especially in nano- and microscale devices.     

稀薄气体二维外部柱体绕流特性研究

本文采用直接模拟蒙特卡罗方法对稀薄气体二维外部柱体绕流问题进行了数值模拟。结果表明:外部绕流问题,在特定情况下会产生激波,激波的产生,不仅与气体的稀薄程度有关,还与来流马赫数有关。而气流与壁面之间的换热,随来流马赫数增加而增加,随气体稀薄程度增加而减小。     

具有局部稀薄气体效应的高超声速尖锥气动加热特征研究

以微钝尖锥为飞行器前缘模型,采用基于分子运动论的DSMC方法模拟不同前缘曲率半径的尖锥在高超声速来流下的气动热环境,计算驻点热流率,并与Fay-Riddell公式和其他修正理论作对比,研究具有局部稀薄气体效应的高超声速尖锥气动加热特征及其变化规律.发现修正的Cheng参数适合作为工程上判断驻点区域稀薄气体效应影响大小的判据.     

基于气体动理论的二维Karman涡街数值模拟

基于从稀薄流到连续流的跨流域气体动理论统一算法(gas-kinetic unified algorithm,GKUA),通过数值求解考虑转动自由度激发的Boltzmann-Rykov模型方程,得到了一种跨流域非定常流动数值模拟的方法.该求解方法以Boltzmann模型方程为控制方程,在常温状态下如果考虑转动能激发的情况...     

Rarefied gas flow through a channel of finite length into a vacuum

A rarefied gas flow through a finite-length channel into a vacuum is studied by the direct simulation Monte Carlo method. The mass flow rate through the channel is calculated over the wide range of gas rarefactions. The analysis of the flow field, both within the channel and in upstream and downstream containers, is presented.     

Numerical Simulations of Unsteady Flows from Rarefied Transition to Continuum Using Gas-Kinetic Unified Algorithm

Numerical simulations of unsteady gas flows are studied on the basis of Gas-Kinetic Unified Algorithm (GKUA) from rarefied transition to continuum flow regimes. Several typical examples are adopted. An unsteady flow solver is developed by solving the Boltzmann model equations, including the Shakhov model and the Rykov model etc. The Rykov kinetic equation involving the effect of rotational energy can be transformed into two kinetic governing equations with inelastic and elastic collisions by integrating the molecular velocity distribution function with the weight factor on the energy of rotational motion. Then, the reduced velocity distribution functions are devised to further simplify the governing equation for one- and two-dimensional flows. The simultaneous equations are numerically solved by the discrete velocity ordinate (DVO) method in velocity space and the finite-difference schemes in physical space. The time-explicit operator-splitting scheme is constructed, and numerical stability conditions to ascertain the time step are discussed. As the application of the newly developed GKUA, several unsteady varying processes of one- and two-dimensional flows with different Knudsen number are simulated, and the unsteady transport phenomena and rarefied effects are revealed and analyzed. It is validated that the GKUA solver is competent for simulations of unsteady gas dynamics covering various flow regimes.     

A fast iterative model for discrete velocity calculations on triangular grids

A fast synthetic type iterative model is proposed to speed up the slow convergence of discrete velocity algorithms for solving linear kinetic equations on triangular lattices. The efficiency of the scheme is verified both theoretically by a discrete Fourier stability analysis and computationally by solving a rarefied gas flow problem. The stability analysis of the discrete kinetic equations yields the spectral radius of the typical and the proposed iterative algorithms and reveal the drastically improved performance of the latter one for any grid resolution. This is the first time that stability analysis of the full discrete kinetic equations related to rarefied gas theory is formulated, providing the detailed dependency of the iteration scheme on the discretization parameters in the phase space. The corresponding characteristics of the model deduced by solving numerically the rarefied gas flow through a duct with triangular cross section are in complete agreement with the theoretical findings. The proposed approach may open a way for fast computation of rarefied gas flows on complex geometries in the whole range of gas rarefaction including the hydrodynamic regime.