1. Department of Physics, McGill University, 3600 Rue University, Montreal, Quebec H3A 2T8, Canada
2. School of Materials Science and Engineering, Beijing Institute of Technology, Beijing 100081, China
3. Department of Chemistry, McGill University, 801 Sherbrooke St. West, Montreal, Quebec H3A 0B8, Canada
4. Centre in Green Chemistry and Catalysis, Department of Chemistry, McGill University, 801 Sherbrooke St. West, Montreal, Quebec H3A 0B8, Canada
5. Department of Materials Engineering, McGill University, 3610 University Street, Montreal, Quebec H3A 0C5, Canada
6. McGill High Performance Computing Centre, École de Technologie Supérieure (ETS), 1100 Rue Notre Dame Ouest, Montreal, Quebec H3C 1K3, Canada