Kavli Affiliate: Kristin A. Persson | First 5 Authors: Max C. Gallant, Matthew J. McDermott, Bryant Li, Kristin A. Persson, | Summary: New computational tools for solid-state synthesis recipe design are needed in order to accelerate the experimental realization of novel functional materials proposed by high-throughput materials discovery workflows. This work contributes a cellular automaton […]
Continue.. ReactCA: A Cellular Automaton for Predicting Phase Evolution in Solid-State Reactions