CP620, Shock Compression of Condensed Matter — 2001 edited by M. D. Furnish, N. N. Thadhani, and Y. Horie © 2002 American Institute of Physics 0-7354-0068-7/02/$ 19.00 MESOSCALE DESCRIPTIONS OF SHOCK-LOADED HETEROGENEOUS POROUS MATERIALS* M. R. Baer and W. M. Trott Engineering Sciences Center Sandia National Laboratories, Albuquerque,NM, 87185 Abstract. Recent simulations and experimental studies have revealed that dispersive waves are associated with impact on heterogeneous materials. The shock response includes fluctuating states and localization effects due to the interaction of multiple waves and deformation at material boundaries. These features have been experimentally-observed using a line-imaging interferometer technique in impact tests on thin porous layers of granular sugar crystals. In this work, three-dimensional numerical simulations are discussed. The focus of this study centers on interrogation of the extensive numerical data from mesoscale simulations. Detailed wave fields are probed using imaging and filtering techniques to determine statistical properties of the shock fields. These methods provide statistical distribution information that will lead to new continuum-level descriptions for shock-loaded heterogeneous materials. INTRODUCTION At the mesoscale, the shock behavior of heterogeneous materials involves multiple waves that interact with material heterogeneities or internal boundaries. For energetic materials, the shock sensitivity of initiation and sustained reaction is known to be controlled by the processes occurring at the mesoscale (1). An ensemble of crystals and binder materials can interact to cause space-time fluctuations of the thermodynamic fields and a localization of energy to trigger reaction. In shocked porous materials the wave fields are three-dimensional and unsteady. Waves arise at contact points and coalesce to produce a distribution of thermal and mechanical states. If the loading is sufficient to cause plastic deformation, internal boundaries fold and form jets upon filling pores. When averaged over a sufficiently large space, a "shock" in heterogeneous material appears to be dispersive as well as being dissipative. Rather than a single jump state, the consolidated material * Sandia is a multiprogram laboratory operated by Sandia Corporation, a Lockheed Martin Company, for the U.S. Department of Energy under contract DE-AC04-94AL85000. 713 contains a distribution of fluctuating states spanning a broad range of length and time scales. Much of this behavior appears similar to the character of turbulence. Although direct numerical simulations of the processes associated with shock-loading heterogeneous materials has revealed various features of the wave fields, much of this new information has yet to be incorporated in continuum-level descriptions. To achieve this goal, data interrogation techniques have been devised to probe the vast quantity of four-dimensional data from detailed numerical simulations. In this work, image-processing software is used to extract statistical properties of distribution states during shock loading of heterogeneous material. AN IMPACT EXPERIMENT Time-resolved measurements often represent averaged wave behavior because the resolution is insufficient to capture the length/time scales associated with the mesoscale. Recently, a line-imaging ORVIS technique has been developed to resolve the detailed response of impact loading in a layer of granular sugar. 0,5 To simplify the computations, the lateral width of the granular layer is reduced to 0.75 mm which is approximately 8 mean particle diameters. Periodic conditions at these boundaries are imposed. A reverse ballistic computation is modeled by imposing an initial velocity condition. A shock load is imparted to the granular column when material stagnates at the hard wall boundary. Tracers at the Kapton/PMMA interface monitor the conditions at the location of the line-imaging ORVIS. All of the relevant material parameters for the granular sugar are given in Table 1. The Kapton and PMMA are modeled as Mie-Grtineisen materials using the CTH EOS database parameters. The numerical resolution was fixed at a cell size of 2 jbim requiring 120 million cells in the computations. These simulations were executed on the ASCI-Red TFLOPS computer using 256 processors. |i cuvis film Ltf ir Figure 1. Experimental configuration for impact on granular sugar layer with line-imaging ORVIS particle velocity measurements. Figure 1 displays a pictorial of the experimental configuration. A 2.27 mm layer of granular sugar (65% TMD) is lightly pressed into a fixture and impacted with a Kel-F faced projectile. A 500 m/s impact condition produces a reflected response in the granular sugar with a mean particle velocity estimated to be 370 m/s. Stress waves traverse the thin granular layer and interact with a 0.23 mm Kapton buffer layer. Transmitted particle velocities are then measured at the Kapton/PMMA window interface. Additional information of the test and measurements is given in Reference 2. Table 1. Granular Sugar EOS/Strength/Fracture Parameters Parameter Particle Size Distribution 46 Jim 64 ^m 91 Jim 116 Jim 138 urn 181 Jim 231 urn 338 urn Crystal Density - p0 Sound Speed - c0 Slope of Us-Up Hugoniot - 5 Gruneisen Parameter - F0 Specific Heat - cv Thermal conductivity - Xs Yield Stress - Y Poisson Ratio -v Fracture Stress - cy MESOSCALE MODELING Three-dimensional numerical simulations of the aforementioned experiment were performed using the Eulerian CTH shock physics code (3) including the effects of material strength and thermal dissipation. The modeling details associated with the particle packing algorithm, material models and boundary conditions are given in Reference 4 and not repeated here. Value Wt. & # fraction: 0.005, 0.265 0.008,0.148 0.020,0.133 0.021,0.068 0.058,0.111 0.165,0.139 0.152,0.062 0.571,0.074 1.5805g/cm3 3.04xl05cm/s 2.05 1.04 1.38X1011 erg/gm-ev 4.86xl08erg/cm2-s-ev 1.1 Kbar 0.25 -2.0 Kbar Figure 2 displays the initial 3D material geometry and later when all of the pores in the granular sugar are filled. (The pore regions of the initial granular material are assumed to be void.) Figure 2 shows a comparison of the ORVIS particle velocity measurements to the CTH predictions. The agreement is reasonably good, particularly since the granular geometry is only statistically represented. Granular sugar is represented as an ensemble of crystals with a predetermined unpressed particle size distribution (5). A closely-packed geometry is created using a MC/MD method with eight classes of particle sizes forming an initial configuration with a density of -65% TMD. Incorporated into this model are the Kapton and PMMA layers of the gauge package. 714 useful in developing improved continuum-level models of shocked heterogeneous materials. The velocity-time profiles at the Kapton/PMMA interface indicate complex transverse mode structure in addition to a ~120 ns rise time. Both experiment and computations exhibit early peaks in the particle velocity followed by the late-time mean velocity of ~ 250 m/s. In this approach, four dimensional data is rendered as planes of gray-scale contours. For example, consider the field of temperatures from a direct numerical simulation as shown in Figure 3. The 370 m/s Transverse cut 65% contours 800 us 0.5 kmte Iippacl CTH. caJc. (spatM average) Figure 3. Gray-scale contours of temperature field at the midplane transverse cut plane. spatial and temporal image planes of information contain a 256 array of pixel intensities spanning a linear range of temperatures. A pixel count per gray-scale intensity yields the distribution of states. This information is directed related to a probability density function (PDF). Furthermore, the set of spatial or temporal planes forms the basis for an ensemble average of the PDF. Figure 2. Top displays initial and compacted 3D material crosssections from numerical simulation and bottom is a comparison of particle velocities at the measurement plane. DATA INTERROGATION Various bands of the PDF can be masked to identify characteristics of the field of interest. Then image data is sampled to assemble relevant statistics such as mean size, area, fractal dimension, etc. Although the line-imaging ORVIS measurements provide insightful information on transmitted wave behavior, the wave fields in the shocked granular material are richly filled with important statistical information related to the fluctuating thermal and mechanical states. However, interrogating the massive quantity of numerical data in these transient three-dimensional parallel computer simulation is a computational intensive task. In this study, image-processing software, such as ImagePro Plus (6), is used to extract statistical information relevant for averaging and filtering the fields Figure 4 displays a representative PDF from an ensemble of temperature contours. Four divisions of the temperature distribution are identified: I - a precusor range associated with elastic stress waves, II - bulk response in which much of the mechanical load is supported, III - a thermal gradient range near grain boundaries and IV - the tail portion of the distribution associated with the localization of energy into "hot-spots". For reactive materials, 715 region IV serve as the trigger of reaction and III is the range associated with the growth of reaction. I II III IV 300. 320. 340. 360. 380. 400. SUMMARY AND CONCLUSIONS This study has focused on probing numerical simulations to extract statistical information needed to define better continuum descriptions of shockloaded heterogeneous materials. Image-processing software has been used as a means of data-mining ensembles of contour planes of information from direct numerical simulations. Representative PDF's of temperature has suggested four aspects of the shock response. Work is in progress to provide statistical information of additional mechanical and thermodynamic fields such as those associated with stress, strain and velocity fluctuations. Future study will explore how these distributions are related to the stochastic geometry and properties of the initial state of the material. Ultimately, this state distribution information will be used in the development of a new paradigm for modeling shocks in heterogeneous materials. 420. 440. 460. 480. 500. Temperature [K] Figure 4. Representative temperature PDF's displaying the four ranges of the temperature field. 1 >385K 0.9 0.8 0.7 0.6 0.5 0.4 0.3 0.2 0.1 0.0 - * • • - 340-385 K -•—310-340 K -o—300-31 OK ACKNOWLEDGEMENTS We would like to thank David Kethison for help with the image-processing. We also thank Steve Sheffield and Rick Gustavsen (LANL) for sharing their sugar EOS and shock Hugoniot data. 1000 500 Time after impact [ns] 1500 REFERENCES 1 Bowden, P.P. and Yoffe, A.D., Initiation and Growth of Explosions in Liquids and Solids, Cambridge University Press, Cambridge, 1952. 2 Trott,W.M., Chhabildas,L.C, Baer, M.R. and Castaneda, J.N., "Investigation of Dispersive Waves in Low-Density Sugar and HMX Using Line-Imaging Velocity Interferometry," (this volume). 3 McGlaun, J.M., Thompson^.L., and Elrick, M.G., "CTH: A Three-Dimensional Shock Wave Physics Code," Int. J. Impact Eng., Vol 10, 351-360, 1990. 4 Baer, M.R., "Computational Modeling of Heterogeneous Reactive Materials at the Mesoscale", Shock Compression of Condensed Matter -1999, edited by M. D. Furnish, L. C. Chhabildas and R. S. Hixson, June, 1999. 5 Trott,W.M., et a/., "Dispersive Velocity Measurements in Heterogeneous Materials", Sandia National Laboratories, SAND2000-3082, December, 2000. 6 Image-Pro Plus v4.2, Media Cybernetics, Silver Springs, MD., 1999. Figure 5. Ensemble-averaged volume fraction for each region of the temperature distribution. Having identified the various regions of the temperature PDF, masks for each of the four parts are superimposed on the contour images, separated from the original image and the statistics are resampled. Figure 5 displays the time evolution of the volume fraction of shocked material corresponding to each part of the temperature distribution function. At this impact condition, roughly 10% of the material contains localized high temperatures forming "hot-spots". The gradient range is seen to be represented by approximately 25% of the volume, hence, the sum of the two parts of the distribution displaces a volume similar to that of the initial porosity. 716
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