1. Sanyo-Onoda City University, 1-1-1 Daigakudori, Sanyo-Onoda, Yamaguchi 756-0884, Japan
2. Cluster for Science, Technology and Innovation Hub, RIKEN, 2-1 Hirosawa, Wako, Saitama 351-0198, Japan
3. University of Strasbourg, Institut de Physique et Chimie des Matériaux de Strasbourg (IPCMS), CNRS, UMR 7504, 23 rue du Loess, F-67034 Strasbourg, France
4. Department of Theoretical and Computational Molecular Science, Institute for Molecular Science, Myodaiji, Okazaki 444-8585, Japan
5. Elements Strategy Initiative for Catalysts and Batteries (ESICB), Kyoto University, Katsura, Kyoto 615-8520, Japan
6. Graduate School of University of Yamanashi, 4-4-37 Takeda, Kofu, Yamanashi 400-8510, Japan
7. Mitsubishi Chemical Corporation, MCC-Group Science and Technology Research Center Inc., 1000 Kamoshida-cho, Aoba-ku, Yokohama 227-8502, Japan
8. Computational Chemistry Applications Unit, Advanced Center for Computing and Communication, RIKEN, 2-1, Hirosawa, Wako, Saitama 351-0198, Japan