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Mesoscale simulation of mixed equations of state with application to shocked platinum-doped PMP foams

Procedia Engineering

Haill, Thomas A.; Mattsson, Thomas; Root, Seth; Magyar, Rudolph J.

Hydrocarbon polymers and foams are utilized in high energy-density physics (HEDP) and inertial confinement fusion (ICF) experiments as tampers, energy conversion and radiation pulse shaping layers in dynamic hohlraum Z-pinches, and ablators in ICF capsule implosions. Shocked foams frequently are found to be mixed with other materials either by intentional doping with high-Z elements or by instabilities and turbulent mixing with surrounding materials. In this paper we present one-dimensional and three-dimensional mesoscale hydrodynamic simulations of high-Z doped poly-(4-methyl-1-pentene) (PMP or TPX) foams in order to examine the validity of various equation of state (EOS) mixing rules available in two state-of-the-art simulation codes. Platinum-doped PMP foam experiments conducted at Sandia's Z facility provide data that can be used to test EOS mixing rules. We apply Sandia's ALEGRA-MHD code and the joint LLNL/SNL KULL HEDP code to model these doped foam experiments and exercise the available EOS mixing methods. One-dimensional simulations homogenize the foam with platinum dopant and show which EOS mixing methods produce results that are consistent with measured Hugoniot states. These simulations produce sharp shock fronts that are well described by traditional Hugoniot relations. Three-dimensional mesoscale simulations explicitly model the foam structure embedded with discrete platinum particles. The heterogeneous structure of the foam results in diffuse shock fronts and an unsteady post-shock state with large fluctuations about an average state. We compare shock propagation through pure foam and Pt-doped foams (50-50 mixture by weight) at equal average initial density, and examine how well the results compare to the experimentally measured Hugoniot states. © 2013 The Authors.

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TYPE Conference YEAR 2013
OSTIScopus

Mesoscale simulation of shocked poly-(4-methyl-1-pentene) (PMP) foams

AIP Conference Proceedings

Haill, Thomas A.; Mattsson, Thomas; Root, Seth; Schroen, D.G.; Flicker, Dawn

Hydrocarbon foams are commonly used in high energy-density physics (HEDP) applications, for example as tamper and ablation materials for dynamic materials or inertial confinement fusion (ICF) experiments, and as such are subject to shock compression from tens to hundreds of GPa. Modeling of macro-molecular materials like hydrocarbon foams is challenging due to the heterogeneous character of the polymers and the complexity of voids and large-scale structure. Under shock conditions, these factors contribute to a relatively larger uncertainty of the post-shock state compared to that encountered for homogenous materials; therefore a quantitative understanding of foams under strong dynamic compression is sought. We use Sandia's ALEGRA-MHD code to simulate 3D mesoscale models of poly-(4-methyl-1-pentene) (PMP) foams. We devise models of the initial polymer-void structure of the foam and analyze the statistical properties of the initial and shocked states. We compare the simulations to multi-Mbar shock experiments conducted on Sandia's Z machine at various initial foam densities and flyer impact velocities. Scatter in the experimental data may be a consequence of the initial foam inhomogeneity. We compare the statistical properties of the simulations with the scatter in the experimental data. © 2012 American Institute of Physics.

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TYPE Conference YEAR 2012
ScopusOSTI

Molecular dynamics simulation of shock-compressed hydrocarbon polymers and foams

ECCM 2012 - Composites at Venice, Proceedings of the 15th European Conference on Composite Materials

Lane, James M.D.; Grest, Gary S.; Mattsson, Thomas

Hydrocarbon polymers, foams and nanocomposites are increasingly being subjected to extreme environments. Molecular scale modeling of these materials offers insight into failure mechanisms and complex response. Classical molecular dynamics (MD) simulations of the principal shock Hugoniot were conducted for two hydrocarbon polymers, polyethylene (PE) and poly(4-methyl-1-pentene) (PMP). We compare these results with recent density functional theory (DFT) calculations and experiments conducted at Sandia National Laboratories. Here, we extend these results to include low-density polymer foams using nonequilibrium MD techniques. We find good quantitative agreement with experiment. Further, we have measured local temperatures to investigate the formation of hot spots and polymer dissociation near foam voids.

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TYPE Conference YEAR 2012
OSTIScopus
Results 101–125 of 185
Results 101–125 of 185