1. Bremen Center for Computational Materials Science, University of Bremen, 28359 Bremen, Germany
2. Warwick Centre for Predictive Modelling, School of Engineering, University of Warwick, Coventry CV4 7AL, United Kingdom
3. School of Science, Constructor University, Campus Ring 1, 28759 Bremen, Germany
4. Computational Science and Applied Research Institute (CSAR), Shenzhen 518110, P. R. China
5. Beijing Computational Science Research Center (CSRC), Beijing 100193, P. R. China