Evolutionary exploration of polytypism in lead halide perovskites
Published in Chemical Science, 2021
Recommended citation: Z. Li, J.-S. Park, A. Walsh. Evolutionary exploration of polytypism in lead halide perovskites. Chem. Sci., 12, 12165-12173, 2021. https://doi.org/10.1039/D1SC02238E
We creatively combined evolutionary algorithm with Ising-type Hamiltonian for efficiently finding the stable and meta-stable polytypes.