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Optimization of Artificial Viscosity in Production Codes Based on Gaussian Regression Surrogate Models

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  • 1 Applied Mathematics and Plasma Physics, Theoretical Division, Mail Stop B284, Los Alamos National Laboratory, Los Alamos, NM 87545, USA;
    2 Continuum Models and Numerical Methods Group, X-Computational Physics Division, Mail Stop F644, Los Alamos National Laboratory, Los Alamos, NM 87545, USA;
    3 Lagrangian Codes Group, X-Computational Physics Division, Mail Stop T086, Los Alamos National Laboratory, Los Alamos, NM 87545, USA

Received date: 2022-09-06

  Revised date: 2023-01-05

  Accepted date: 2023-01-06

  Online published: 2024-12-20

Supported by

This work was performed under the auspices of the National Nuclear Security Administration of the US Department of Energy at Los Alamos National Laboratory under Contract No. 89233218CNA000001. The Authors gratefully acknowledge the support of the US Department of Energy National Nuclear Security Administration Advanced Simulation and Computing Program. LA-UR-22-33159.

Abstract

To accurately model flows with shock waves using staggered-grid Lagrangian hydrodynamics, the artificial viscosity has to be introduced to convert kinetic energy into internal energy, thereby increasing the entropy across shocks. Determining the appropriate strength of the artificial viscosity is an art and strongly depends on the particular problem and experience of the researcher. The objective of this study is to pose the problem of finding the appropriate strength of the artificial viscosity as an optimization problem and solve this problem using machine learning (ML) tools, specifically using surrogate models based on Gaussian Process regression (GPR) and Bayesian analysis. We describe the optimization method and discuss various practical details of its implementation. The shock-containing problems for which we apply this method all have been implemented in the LANL code FLAG (Burton in Connectivity structures and differencing techniques for staggered-grid free-Lagrange hydrodynamics, Tech. Rep. UCRL-JC-110555, Lawrence Livermore National Laboratory, Livermore, CA, 1992, 1992, in Consistent finite-volume discretization of hydrodynamic conservation laws for unstructured grids, Tech. Rep. CRLJC-118788, Lawrence Livermore National Laboratory, Livermore, CA, 1992, 1994, Multidimensional discretization of conservation laws for unstructured polyhedral grids, Tech. Rep. UCRL-JC-118306, Lawrence Livermore National Laboratory, Livermore, CA, 1992, 1994, in FLAG, a multi-dimensional, multiple mesh, adaptive free-Lagrange, hydrodynamics code. In: NECDC, 1992). First, we apply ML to find optimal values to isolated shock problems of different strengths. Second, we apply ML to optimize the viscosity for a one-dimensional (1D) propagating detonation problem based on Zel’dovich-von NeumannDoring (ZND) (Fickett and Davis in Detonation: theory and experiment. Dover books on physics. Dover Publications, Mineola, 2000) detonation theory using a reactive burn model. We compare results for default (currently used values in FLAG) and optimized values of the artificial viscosity for these problems demonstrating the potential for significant improvement in the accuracy of computations.

Cite this article

Vitaliy Gyrya, Evan Lieberman, Mark Kenamond, Mikhail Shashkov . Optimization of Artificial Viscosity in Production Codes Based on Gaussian Regression Surrogate Models[J]. Communications on Applied Mathematics and Computation, 2024 , 6(3) : 1521 -1550 . DOI: 10.1007/s42967-023-00251-3

References

1. Aslam, T.:Shock temperature dependent rate law for plastic bonded explosives. J. Appl. Phys. 123, 145901 (2018)
2. Barlow, A., Shashkov, M.J., Maire, P.-H., Rieben, R., Rider, W.:Arbitrary Lagrangian-Eulerian methods for modeling high-speed compressible multimaterial flows. J. Comput. Phys. 322, 603-665 (2016)
3. Bishop, C.M.:Pattern Recognition and Machine Learning. Springer, Berlin (2006)
4. Burton, D.:Connectivity structures and differencing techniques for staggered-grid free Lagrange hydrodynamics. Tech. Rep. UCRL-JC-110555, Lawrence Livermore National Laboratory, Livermore, CA, 1992 (1992)
5. Burton, D.:Consistent finite-volume discretization of hydrodynamic conservation laws for unstructured grids. Tech. Rep. CRL-JC-118788, Lawrence Livermore National Laboratory, Livermore, CA, 1992 (1994)
6. Burton, D.:Multidimensional discretization of conservation laws for unstructured polyhedral grids. Tech. Rep. UCRL-JC-118306, Lawrence Livermore National Laboratory, Livermore, CA, 1992 (1994)
7. Burton, D.E.:FLAG:a multi-dimensional, multiple mesh, adaptive free-Lagrange, hydrodynamics code. In:Nuclear Explosives Code Development Conference (1992)
8. Campbell, J., Shashkov, M.:A tensor artificial viscosity using a mimetic finite difference algorithm. J. Comput. Phys. 172, 739-765 (2001)
9. Caramana, E., Burton, D., Shashkov, M., Whalen, P.:The construction of compatible hydrodynamics algorithms utilizing conservation of total energy. J. Comput. Phys. 146, 227-262 (1998)
10. Fickett, W., Davis, W.:Detonation:Theory and Experiment, Dover Books on Physics. Dover Publications, Minoela (2000)
11. Gramacy, R.B.:Surrogates:Gaussian Process Modeling, Design and Optimization for the Applied Sciences. Chapman Hall/CRC, Boca Raton, Florida (2020)
12. Kenamond, M., Bement, M., Shashkov, M.:Compatible, total energy conserving and symmetry preserving arbitrary Lagrangian-Eulerian hydrodynamics in 2D rz-cylindrical coordinates. J. Comput. Phys. 268, 154-185 (2014)
13. Kennedy, M.C., O'Hagan, A.:Bayesian calibration of computer models. J. R. Stat. Soc. Ser. B (Statistical Methodology) 63, 425-464 (2001)
14. Landshoff, R.:A numerical method for treating fluid flow in the presence of shocks. Tech. Rep. LA-1930, Los Alamos National Laboratory, Los Alamos, NM (1955)
15. Lipnikov, K., Shashkov, M.:A framework for developing a mimetic tensor artificial viscosity for Lagrangian hydrocodes on arbitrary polygonal meshes. J. Comput. Phys. 229, 7911-7941 (2010)
16. Mockus, J., Tiesis, V., Zilinskas, A.:The application of Bayesian methods for seeking the extremum. In:Towards Glob. Optim. North-Holland, Amsterdam (1978)
17. Price, A.:ZND verification tests for reactive burn models in FLAG. Tech. Rep. LA-UR-20-21911, Los Alamos National Laboratory (1990)
18. Prunty, S.:Introduction to Simple Shock Waves in Air. With Numerical Solutions Using Artificial Viscosity. Springer, Berlin (2019)
19. Rasmussen, C.E., Williams, C.K.I.:Gaussian Processes for Machine Learning. Massachusetts Institute of Technology, Cambridge (2006)
20. Schonlau, M., Welch, W.J., Jones, D.R.:Global versus local search in constrained optimization of computer models. Lect. Notes-Monogr. Ser. 34, 11-25 (1998)
21. Toro, E.:Riemann Solvers and Numerical Methods for Fluid Dynamics. A Practical Introduction. Springer, Berlin (2009)
22. Von Neumann, J., Richtmyer, R.:A method for the numerical calculation of hydrodynamic shocks. J. Appl. Phys. 21, 232-237 (1950)
23. Wescott, D., Stewart, B.L., Davis, W.:Equation of state and reaction rate for condensed-phase explosives. J. Appl. Phys. 98, 053514 (2005)
24. Wilkins, M.L.:Use of artificial viscosity in multidimensional fluid dynamic calculations. J. Comput. Phys. 36, 281-303 (1980)
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