1. Pitzer Center for Theoretical Chemistry, Department of Chemistry, University of California, Berkeley, California 94720, United States
2. Advanced Light Source, Lawrence Berkeley National Laboratory, Berkeley, California 94720, United States
3. Computational Research Division, Center for Advanced Mathematics for Energy Research Applications (CAMERA), Lawrence Berkeley National Laboratory, Berkeley, California 94720, United States
4. Pitzer Center for Theoretical Chemistry, Department of Chemistry, Department of Bioengineering, Department of Chemical and Biomolecular Engineering, University of California, Berkeley, California 94720, United States