1. Mathematics for Advanced Materials-Open Innovation Laboratory (MathAM-OIL), National Institute of Advanced Industrial Science and Technology (AIST), c/o Advanced Institute for Materials Research (AIMR), Tohoku University, 2-1-1 Katahira, Aoba, 980-8577 Sendai, Japan
2. Research Center for Computational Design of Advanced Functional Materials (CD-FMat), National Institute of Advanced Industrial Science and Technology (AIST), 1-1-1 Umezono, 305-8568 Tsukuba, Japan
3. School of Science, RMIT University, GPO Box 2476, Melbourne, 3001 Victoria, Australia