1. Department of Chemistry, Johns Hopkins University, Baltimore, Maryland 21218, USA
2. Advanced Computing, Mathematics and Data Division, Pacific Northwest National Laboratory, Richland, Washington 99354, USA
3. Institute for Physical Chemistry, Technical University of Munich, 85748 Garching, Germany
4. Key Laboratory of Advanced Energy Materials Chemistry (Ministry of Education), College of Chemistry, Nankai University, Tianjin 30071, China
5. Department of Chemistry, University of Washington, Seattle, Washington 98195, USA