Reconstruction of periodic unit cells of multimodal random particulate composites using genetic algorithms

We develop a procedure for characterization and reconstruction of periodic unit cells of highly filled, multimodal, particulate composites. Rocpack, a particle packing software, is used to generate the solid propellant microstructures and one- and two-point probability functions are used to describe its statistical morphology. The reconstruction is carried out using a parallel Augmented Simulated Annealing algorithm with a novel mutation operator based on a mass–spring system to eliminate overlap and improve the code performance. Results from the reconstruction procedure, for four-phase random particulate composites of 40–70% packing fraction, are detailed to demonstrate the capabilities of the reconstruction model. The presented results suggest good convergence and repeatability of the optimization scheme, even for high volume fractions, and good scalability of the algorithm.