1. Department of Chemistry and Molecular Design Institute, New York University, New York, New York 10003 United States
2. Department of Chemistry, New York University, New York, New York 10003 United States
3. Courant Institute of Mathematical Sciences, New York University, New York, New York 10012, United States
4. NYU-ECNU Center for Computational Chemistry, New York University Shanghai, Shanghai 200062, China