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 MODELING AND SIMULATION OF EXPLOSIVELY DRIVEN ELECTROMECHANICAL DEVICES Paul N. Demmie Sandia National Laboratories* Box 5800, MS0820, Albuquerque, NM871S5 Abstract. Components that store electrical energy in ferroelectric materials and produce currents when their permittivity is explosively reduced are used in a variety of applications. The modeling and simulation of such devices is a challenging problem since one has to represent the coupled physics of detonation, shock propagation, and electromagnetic field generation. The high fidelity modeling and simulation of complicated electromechanical devices was not feasible prior to having the Accelerated Strategic Computing Initiative (ASCI) computers and the ASCI developed codes at Sandia National Laboratories (SNL). The EMMA computer code is used to model such devices and simulate their operation. In this paper, I discuss the capabilities of the EMMA code for the modeling and simulation of one such electromechanical device, a slim-loop ferroelectric (SFE) firing set. INTRODUCTION WHAT IS A FIRING SET? In this paper, I discuss the capabilities of the EMMA computer code (1) for modeling an SFE firing set and simulating its operation with the added complexity of assessing its performance with aged materials. A firing set is a device whose purpose is to remain in an inactive state and initiate detonators in a safe and reliable manner only when intended. The type of firing set discussed here stores electrical energy in the SFE material, PBZT (2) when a voltage is applied and releases this energy into circuits when the permittivity of the PBZT is explosively reduced. This material is desirable since its low remanent polarization renders the device safe when the charging voltage is removed. Figure 1 is an exterior view of an SFE filing set. THE EMMA COMPUTER CODE Figure 1. Exterior view of an SFE firing set. EMMA was used to model the firing set shown in Fig. 1 and to simulate its operation. EMMA is based on the ALEGRA computer code (1) that is an arbitrary Lagrangian-Eulerian, material-dynamics code that accommodates large deformations and In the following sections I address: what is a firing set, the EMMA computer code, the EMMA computational model, verification of the model, summary of the validation process, and conclusions and discussion. Sandia is a multiprogram laboratory operated by Sandia Corporation, a Lockheed Martin Company, for the United States Department of Energy under Contract DE-AC04-94AL85000 311 strong shock physics. EMMA adds to ALEGRA the capabilities to perform electromagnetic field calculations based on a quasi-static approximation to Maxwell's equations and to model circuits. Electromechanical models were developed and implemented in the EMMA code to represent materials such as the ferroelectric material PBZT. The programmed-burn model is used to model the explosive. The CHEETA computer code (3) was used to determine all input required by EMMA for the explosive. CHEETA determines all reaction-state parameters for a given explosive with a specified unreacted density under the assumption of one-dimensional, perfect detonation. Aging effects in the explosive can be incorporated into the programmed-burn model through measurements of unreacted density or detonation velocity (DV). Two types of experiments were performed to determine the DV for the explosive, DV-block experiments and rheology-block experiments. The difference between these experiments is that the tracks are straight in the DV-block experiments and are curved in the rheology-block experiments. The average DV obtained from these experiments is 7272 km/s. CHEETA showed that this velocity corresponds to an unreacted density of 1490 kg/m3. The explosive lens includes a cover plate, track plate, isolation plate, and output plate. The plates are made of chemically inert Lexan and have welldefined geometry. The tracks in the track plate are filled with explosive. The detonation propagates along the tracks in the track plate shown in Fig. 3, down holes in the plate, and to explosive pellets in the output plate. It also propagates along timing tracks to locations of switches that close when the pressure wave reaches them. The effect of this configuration is to produce a nearly plane wave in the SFE stack. No aging effects are known or expected for the Lexan in the explosive lens, THE EMMA COMPUTATIONAL MODEL Figure 2 is an exploded view of the SFE firing set shown in Fig. 1. OEflltllCfl Figure 2. Exploded view of an SFE firing set. We developed a comprehensive, high fidelity, three-dimensional model of a firing set from the cover plate through the ceramic backup plate with attached test circuits and without the detonator. The elements of the EMMA computational model are: • Explosive • Explosive Lens • Buffer Plate • SFE Ceramic Elements • Mylar Layer and Electrode Interfaces • Transducer and Output Circuits • Explosively Inert Regions (everything else) Values for material properties were found in the literature or data from experiments. This model is the best-estimate representation of the firing set with attached test circuits and without the detonator. It contains 9,021,601 nodes and 8,878,535 elements, A typical simulation requires about 36 hours on the ASCI Red computer. Figure 3. Track plate. The buffer plate is made of alumina and has well-defined geometry and material properties. No aging effects are known or expected. The SFE elements are made of PBZT. The dynamic properties of a charged PBZT element being shattered by a shock wave were the biggest unknowns. No aging effects are known or expected 312 for this element, but can be incorporated through the many parameters in the model. Experimental data were used to calibrate the electromechanical model for PBZT. In this model, the stress and dielectric tensors are coupled under the assumption of uniaxial strain by the electrostrictive coupling parameters. The coupling parameters specify a function that is proportional to the reciprocal of the relative permittivity. Experiments using a gas gun to shatter PBZT elements were performed at SNL to determine these parameters. The Mylar layer between the buffer plate and the SFE stack is an important feature of this firing set and is designed to reduce the pressures in the SFE stack so that electrical conduction does not occur in the PBZT elements. Inclusion of this thin but necessary feature, as well as the electrodes with a rubberized material on each surface, is part of the present work. Results of simulations using this higher-fidelity model are not available at this time. Test firings of the device used known circuits. Transducer and output circuits were modeled using resistances and inductances listed in the diagrams for these circuits. We also included values for resistance and inductance of the attached wiring and internal to the firing set. Estimates of the internal resistances and inductances were obtained using the DAKOTA (4) and Spice (5) computer codes and data from test firings. SFE ceramic stack. Figure 5 compares calculated and measured output currents in the two circuits. These figures imply that the features listed are present in an EMMA simulation. VERIFICATION OF THE MODEL SUMMARY OF THE VALIDATION PROCESS Verification is the process of determining that a computer simulation correctly represents the conceptual model and its solution. The features expected for a correct representation of the performance of an SFE firing set are • A detonation propagates in the track plate, • detonates the explosive pellets in the output plate, • produces pressures waves that propagate through the buffer plate and into the SFE ceramic stack, • shatters the SFE ceramics, and • produces currents in the circuits Figure 4 shows propagation of a detonation in a section of the track plate and propagation of pressure waves and electric field production in the Validation is the process of determining the degree to which a computer simulation is an accurate representation of the real world. Five types of experiments were performed at SNL that provided data for the validation process. The first type of experiment is a test firing of the device. Features of interest include peak current, difference in closure time of switches, width at half height (time difference at halfmaximum current), and pulse length. We have data for 29 experiments for this SFE firing set. Figure 5 shows the calculated and measured currents for one test firing. This figure shows that the calculated peak values of current and the width at half height agree very well with the measured values. However, the pulse lengths do not agree as well. Finally, the calculated value for difference in Figure 4. Propagation of detonation in track plate, pressure waves in buffer plate, and electromagnetic field in SFE stack. ';^^ m y '^'^^^mMA^M^M 11 TIME Figure 5. Calculated and measured currents. (This figure is in color on the CD.) switch-closure time differs significantly from the measured value. In the second type of experiment, the buffer plate and ceramic stack were removed and replaced by a Lexan block with holes where sensors could determine time of arrival of a detonation. In the third type of experiment, material below the track plate was removed and sensors were placed to measure time of arrival of a detonation at locations in the track plate. From these data and calculated distances, average velocities could be determined. In both types of experiments the difference between DVs determined from calculations and measurements differed by less than 1%. This agreement indicates that the programmed-burn model works extremely well. The fourth type of experiment was designed specifically for validation. In these experiments, locations in the track plate were blocked so that the detonation would not propagate past these blockages and 50%, 25%, 72.5%, and 6.25% of the explosive pellets could not be detonated. For both circuits, the calculated fractions of peak current differ from the measured values by less than 2%. In the fifth type of experiment, material below the SFE stack was removed and replaced with polymethylmethacrylate (PMMA). VISAR (velocity interferometer system for any reflecting surface) measurements were made to determine pressures just below the SFE stack. We are waiting for results to compare with EMMA simulation results. These experiments are very important to determine how well the computational model is an accurate representation of the real world. CONCLUSIONS AND DISCUSSION EMMA is a viable analytic tool for modeling an SFE firing set and simulating its operation. A verification process shows that the EMMA computational model correctly represents the conceptual model of an SFE firing set and its solution. A validation process indicates that, while many features of the EMMA model represent reality well, there is room for improvement. Experiments indicate that PBZT is conductive at the fields and pressures currently calculated by EMMA. Since the device was designed so that conduction does not occur in the SFE stack, present work focuses on a higher-fidelity model that includes the Mylar layer and all coated-electrode interlaces to improve pressure prediction. We have data for validating this model. Experiments also indicate the electrostrictive coupling parameters are functions of strain and electric field strength. Therefore, a new electromechanical model for the PBZT is being developed and implemented in EMMA. There is uncertainty in the modeling of any physical system and in simulating its performance. Therefore, an important part of this work is to perform sensitivity studies to determine the effects of variations in selected input parameters and modeling features. Simulation results and results from sensitivity studies that are not discussed here support the position that this filing set is a robust device and is expected to perform its intended function as it ages. REFERENCES 1. Computational Physics R&D Department, ALEGRA User Input and Physics Descriptions Version 4, Draft SAND document, SNL, Albuquerque, NM (2001). 2. Samara, G. V., and Hansen, L. V., The Properties and Physics of the Slim-Loop Ferroelectric (SFE) (Pb71Ba,29).99(Zr7o7Ti,293).98B(o203) SAND98-2275, SNL, Albuquerque, NM (1998). 3. Fried, L. E., CHEETA 139 User's Manual, UCRLOMA0116541, Rev. 3, Lawrence Livermore National Laboratory, Livermore, CA (1996). 4. Eldred, M. S., Bohnhoff, W. I, Hart, W. E., DAKOTA, A Multilevel Parallel Object-Oriented Framework for Design Optimization, Parameter Estimation, Sensitivity Analysis, and Uncertainty Quantification, SAND99-QOOO, SNL Albuquerque, NM (1999). 5. Johnson, B. T., SPICES Version 3f Users Manual, University of California, Berkeley, CA (1992).
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