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DOE OSTI2024

A mineral precipitation model based on the volume of fluid method

A novel volume of fluid method is presented for mineral precipitation coupled with fluid flow and reactive transport. The approach describes the fluid-solid interface as a smooth transitional region, which is designed to provide the same precipitation rate and viscous drag force as a sharp interface. Specifically, the governing equation of mineral precipitation is discretized by an upwind scheme, and a rigorous effective viscosity model is derived around the interface. The model is validated against analytical solutions for mineral precipitation in channel and ring-shaped structures. It also compares well with interface tracking simulations of advection-diffusion-reaction problems. Here, the methodology is finally employed to model mineral precipitation in fracture networks, which is challenging due to the low porosity and complex geometry. Compared to other approaches, the proposed model has a concise algorithm and contains no free parameters. In the modeling, only the pore space requires meshing, which improves the computational effciency especially for low-porosity media.

58 GEOSCIENCES↗

DOE OSTI2020

An open source fast fluid dynamics model for data center thermal management

Although computational fluid dynamics (CFD) has been widely adopted to improve data center thermal management, the high computational demand limits its applications, such as multivariate optimal design and operation. Fast fluid dynamics (FFD), which has been applied for fast airflow simulation, shows great potential. However, few research applied FFD for optimal design and operation of data center thermal management. This research improves the FFD model for data centers and conducts a comprehensive evaluation and demonstration. First, the FFD model is improved by solving the advection and diffusion equations together using an upwind scheme instead of a semi-Lagrangian advection solver in the conventional FFD model. Second, new features for data centers are added, such as a pressure correction method to simulate plenum airflow and dynamic boundary conditions for IT racks. The new FFD model is first validated with two indoor environment cases and the results show that the new FFD model has slightly better overall prediction accuracy and faster speed compared to the conventional FFD model. It is also observed that both FFD models achieve acceptable accuracy, except for a few localized disparities with experimental data, which might be due to simplified handling of turbulence viscosity near the boundaries. Furthermore, validation with a real data center shows that the FFD model achieves a similar level of accuracy as CFD when compared to the experimental measurements with some level of uncertainties. It is then demonstrated for data center optimal design and operation, which saves 53.4–58.8% of annual energy while still meeting the thermal requirements. In conclusion, with a much faster speed and comparable accuracy compared to CFD, the FFD model parallelized on a graphics processing unit is promising for practical model-based data center early design and operation.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

DOE OSTI2021

TRITON: A Multi-GPU open source 2D hydrodynamic flood model

A new open source multi-GPU 2D flood model called TRITON is presented in this work. The model solves the 2D shallow water equations with source terms using a time-explicit first order upwind scheme based on an Augmented Roe's solver that incorporates a careful estimation of bed strengths and a local implicit formulation of friction terms. Here, the scheme is demonstrated to be first order accurate, robust and able to solve for flows under various conditions. TRITON is implemented such that the model effectively utilizes heterogeneous architectures, from single to multiple CPUs and GPUs. Different test cases are shown to illustrate the capabilities and performance of the model, showing promising runtimes for large spatial and temporal scales when leveraging the computer power of GPUs. Under this hardware configuration, communication and input/output subroutines may impact the scalability. The code is developed under an open source license and can be freely downloaded in https://code.ornl.gov/hydro/triton.

2D flood model↗

DOE OSTI2020

Spatiotemporally dynamic implicit large eddy simulation using machine learning classifiers

In this article, we utilize machine learning to dynamically determine if a point on the computational grid requires implicit numerical dissipation for large eddy simulation (LES). The decision making process is learnt through a priori training on quantities derived from direct numerical simulation (DNS) data. In particular, we compute eddy-viscosities obtained through the coarse-graining of DNS quantities and utilize their projection onto a Gaussian distribution to categorize areas that may require dissipation. If our learning determines that closure is necessary, an upwinded scheme is utilized for computing the non-linear Jacobian. In contrast, if it is determined that closure is unnecessary, a symmetric and second-order accurate energy and enstrophy preserving Arakawa scheme is utilized instead. This results in a closure framework that precludes the specification of any model-form for the small scale contributions of turbulence but deploys an appropriate numerical dissipation from explicit closure driven hypotheses. Here, this methodology is deployed for the Kraichnan turbulence test-case and assessed through various statistical quantities such as angle-averaged kinetic energy spectra and vorticity structure functions. Our framework thus establishes a link between the use of explicit LES ideologies for closure and numerical dissipation-based modeling of turbulence leading to improved statistical fidelity of a posteriori simulations.

42 ENGINEERING↗

NASA NTRS1983

On a finite-difference method for solving transient viscous flow problems

A method has been developed to solve the unsteady, compressible Navier-Stokes equation with the property of consistency and the ability of minimizing the equation stiffness. It relies on innovative extensions of the state-of-the-art finite-difference techniques and is composed of: (1) the upwind scheme for split-flux and the central scheme for conventional flux terms in the inviscid and viscous regions, respectively; (2) the characteristic treatment of both inviscid and viscous boundaries; (3) an ADI procedure compatible with interior and boundary points; and (4) a scalar matrix coefficient including viscous terms. The performance of this method is assessed with four sample problems; namely, a standing shock in the Laval duct, a shock reflected from the wall, the shock-induced boundary-layer separation, and a transient internal nozzle flow. The results from the present method, an existing hybrid block method, and a well-known two-step explicit method are compared and discussed. It is concluded that this method has an optimal trade-off between the solution accuracy and computational economy, and other desirable properties for analyzing transient viscous flow problems.

Li, C. P.↗

NASA NTRS1986

Analysis of the transient behavior of rubbing components

Finite element equations are developed for studying deformations and temperatures resulting from frictional heating in sliding system. The formulation is done for linear steady state motion in two dimensions. The equations include the effect of the velocity on the moving components. This gives spurious oscillations in their solutions by Galerkin finite element methods. A method called streamline upwind scheme is used to try to deal with this deficiency. The finite element program is then used to investigate the friction of heating in gas path seal.

Quezdou, M. B.↗

NASA NTRS1985

AOTV bluff body flow - Relaxation algorithm

Preliminary investigations have led to the consideration of two classes of energy efficient aeroassisted orbital transfer vehicle (AOTV) concepts, with high and low L/D. The AOTV represent reentry space vehicles which are to fly hypersonically in the continuum upper reaches of the atmosphere. Problems arise in connection with convective and nonequilibrium radiative heating. As the possibilities for obtaining needed information by experimentation are limited, reliance must be placed on computational techniques to simulate testing of design concepts. A new relaxation algorithm for the compressible Navier-Stokes equations has been developed in the context of recent work with a conservative flux difference eigenvector split implicit upwind scheme CSCM (conservative supracharacteristics method). Attention is given to the CSCM implicit method, and early results for axisymmetric bluff body flow including complete forebody and base flow for a free flight range model drag brake AOTV.

Lombard, C. K.↗

NASA NTRS1987

Navier-Stokes simulation of real gas flows in nozzles

Air flow in a hypersonic nozzle causes real gas effects due to reaction among the species constituting air. Such reactions may be in chemical equilibrium or in chemical nonequilibrium. Here using the CSCM upwind scheme for the compressible Navier-Stokes equations, the real gas flowfield in an arcjet nozzle is computed for both the equilibrium case and the nonequilibrium case. A hypersonic nozzle flow arising from a pebble bed heated plenum is also computed for the equilibrium situation. Between the equilibrium cases, the chemistry is treated by two different schemes and comments are made as to computational complexity. For the nonequilibrium case, a full set of seventeen reactions and full implicit coupling of five species with gasdynamics is employed to compute the flowfield. For all cases considered here the gas is assumed to be a calorically imperfect mixture of ideal gases in thermal equilibrium.

Nagaraj, N.↗

NASA NTRS1987

Calculation of wall and free turbulent-shear flows at supersonic speeds

Supersonic turbulent flows are simulated numerically by solving the Reynolds-averaged full Navier-Stokes equations by an implicit finite-volume method. This flux-vector-split upwind scheme uses approximate factorization followed by line-Gauss-Seidel relaxations. The effects of turbulence are modeled by two eddy viscosity models. High-Reynolds-number form of the k-epsilon model is coupled with a wall-function to avoid excessive refinement of the grid in the low-Reynolds number regions. The k-epsilon equations are solved by the explicit-implicit MacCormack method. The algebraic Baldwin-Lomax model is also being used as an inexpensive alternative for the cases which do not experience massive separation. Several examples of two-dimensional solutions are given to illustrate both wall and free turbulent shear flows which include fluid dynamic phenomena, such as shocks, boundary layers, shear layers, wakes, separations and recirculations. The results compared with experimental data show good agreeent.

Baysal, O.↗

NASA NTRS1988

Numerical simulation of underexpanded plumes using upwind algorithms

The solution of the flow characteristics of highly underexpanded plumes is presently sought by means of a high-resolution total variation-diminishing upwind scheme featuring finite-volume metrics, Roe averaging with entropy correction, and monotonic upstream schemes for conservation laws. The existing approximate factorization schemes are used both as preconditioners and in order to apply the conjugate residual algorithm. The plumes treated are axisymmetric and laminar, and for an ideal gas that is allowed to be thermally incomplete. Simulations of the SSME and SRB plumes have been successfully conducted.

Obayashi, Shigeru↗

NASA NTRS1988

Aerodynamic applications of an efficient incompressible Navier-Stokes solver

A robust and accurate upwind scheme based on flux-difference splitting for three-dimensional, incompressible flows in general coordinates is described. Viscous effects are included through a thin-layer approximation to the Navier-Stokes equations. Turbulent flows are simulated with extensions to the Baldwin-Lomax (1978) turbulence model. The effects of accuracy and gridding on the computed flow field results are assessed. The results obtained from the code for vortical flows over a delta wing, a double delta wing, and a tangent-ogive forebody compare well with experimental data.

Hartwich, Peter M.↗

NASA NTRS1987

An implicit flux-split algorithm for the compressible Navier-Stokes equations

An implicit upwind scheme for the compressible Navier-Stokes equations is described and applied to the internal flow in a dual-throat nozzle. The method is second-order accurate spatially and naturally dissipative. A spatially-split approximate factorization method is used to obtain efficient steady-state solutions on the NASA Langley VPS-32 (CYBER 205) supercomputer.

Thomas, James L.↗

NASA NTRS1990

Shock interference studies on a circular cylinder at Mach 16

This paper presents the results of a computational study on the shock interference problems on a cylindrical body typical of an engine inlet cowl leading edge at a nominal Mach number of 16. The two-dimensional Navier-Stokes equations are solved assuming the flow to be in chemical and thermal equilibrium and using a finite element method. The algorithm employs a cell-centered fully implicit upwind scheme. Adaptively generated unstructured meshes of triangles and quadrilaterals are employed. Under certain conditions the finite element code resulted in oscillatory solutions for shock interference at Mach 16. Some of the causes of the unsteady behavior are identified, and to the extent possible, such situations are avoided in the present application. Two shock interference conditions involving a Type IV (supersonic jet) and a Type III (attaching shear layer) are solved. The results are compared with available experimental data and reasonable agreement is observed. A semi-empirical method is also used to estimate the maximum surface heat flux and static pressure.

Prabhu, Ramadas K.↗

NASA NTRS1990

Numerical methods for TVD transport and coupled relaxing processes in gases and plasmas

The construction of second-order upwind schemes for nonequilibrium plasmas, for both one- and two-fluid formulations is demonstrated. Coupled relaxation processes, including ionization kinetics and radiative processes and their algorithms for nonequilibrium, multiple temperature conditions are described as well. The paper applies the numerical techniques on some simple test cases, points out critical problems and their solutions, and makes qualitative comparisons with known results, whenever possible.

Cambier, Jean-Luc↗

NASA NTRS1989

Prediction of turbine rotor-stator interaction using Navier-Stokes methods

Flows in turbomachinery are generally complex and do not easily lend themselves to numerical computation. The flows are three-dimensional and inherently unsteady. Complicated blade geometries and flow phenomena such as separation and periodic transition from laminar to turbulent flow add to the numerical complexity. Nevertheless, the accurate numerical analysis of such flows is a problem of considerable interest and practical importance to the turbomachinery community. Much of the early work in turbomachinery flow prediction focussed on airfoil cascades. While such analyses of flows in isolated airfoil rows have helped improve understanding of the flow phenomena and have gained widespread acceptance in the industrial community as a design tool, they do not yield any information regarding the unsteady effects arising out of rotor-stator aerodynamic interaction. These interaction effects become increasingly important as the distance between successive stator and rotor rows is decreased. Thus, the need exists for analytical tools that treat the rotor and stator airfoils as a system and provide information regarding the magnitude and the impact of the unsteady effects. The focus a three-dimensional, time-accurate, thin-layer Navier-Stokes code that was recently developed to study rotor-stator interaction problems. A system of patched and overlaid grids that move relative to each other is used to discretize the flow field and the governing equations are integrated using a third-order upwind scheme set in an iterative, implicit framework. The code was used to simulate subsonic flow through an axial turbine configuration for which considerable experimental data exists. Grid refinement studies were also conducted as part of the code validation process. The current status of the research, along with planned future directions, are also discussed.

Madavan, Nateri K.↗

NASA NTRS1990

A multiblock multigrid three-dimensional Euler equation solver

Current aerodynamic designs are often quite complex (geometrically). Flexible computational tools are needed for the analysis of a wide range of configurations with both internal and external flows. In the past, geometrically dissimilar configurations required different analysis codes with different grid topologies in each. The duplicity of codes can be avoided with the use of a general multiblock formulation which can handle any grid topology. Rather than hard wiring the grid topology into the program, it is instead dictated by input to the program. In this work, the compressible Euler equations, written in a body-fitted finite-volume formulation, are solved using a pseudo-time-marching approach. Two upwind methods (van Leer's flux-vector-splitting and Roe's flux-differencing) were investigated. Two types of explicit solvers (a two-step predictor-corrector and a modified multistage Runge-Kutta) were used with multigrid acceleration to enhance convergence. A multiblock strategy is used to allow greater geometric flexibility. A report on simple explicit upwind schemes for solving compressible flows is included.

Cannizzaro, Frank E.↗

NASA NTRS1991

A fast upwind solver for the Euler equations on three-dimensional unstructured meshes

An upwind scheme is presented for solving the three-dimensional Euler equations on unstructured tetrahedral meshes. Spatial discretization is accomplished by a cell-centered finite-volume formulation using flux-difference splitting. Higher-order differences are formed by a novel cell reconstruction process which results in computational times per cell comparable to those of structured codes. The approach yields highly resolved solutions in regions of smooth flow while avoiding oscillations across shocks without explicit limiting. Solutions are advanced in time by a 3-stage Runge-Kutta time-stepping scheme with convergence accelerated to steady state by local time stepping and implicit residual smoothing. Solutions are presented for a range of configurations in the transonic speed regime to demonstrate code accuracy, speed, and robustness. The results include an assessment of grid sensitivity and convergence acceleration by mesh sequencing.

Frink, Neal T.↗

NASA NTRS1991

The prediction of viscous hypersonic flows about complex configurations using an upwind parabolized Navier-Stokes code

A three-dimensional parabolized Navier-Stokes computer code which employs an upwind algorithm is used to conduct a numerical study of an advanced maneuvering reentry vehicle configuration. Comparisons between numerical solutions and experimental data are presented for surface pressure, wall heat flux, and overall forces and moments. The effects of angle of attack, angle of yaw, and surface mass injection are investigated. Good agreement is observed between the calculated and measured data. The results of this investigation demonstrate the accuracy and efficiency of an upwind scheme in predicting the hypersonic flow field characteristics about a complex configuration.

Narain, J. P.↗