1. Department of Chemistry, Washington State University, Pullman, Washington 99163, United States
2. Department of Mathematics, Colorado State University, Fort Collins, Colorado 80523, United States
3. Departments of Chemistry, Chemical and Biomolecular Engineering, and Materials Science and Engineering, Johns Hopkins University, Baltimore, Maryland 21218, United States
4. Department of Chemistry, University of Southern California, Los Angeles, California 90089, United States
5. Theoretical Division, Los Alamos National Laboratory, Los Alamos, New Mexico 87545, United States
6. Department of Chemical and Biomolecular Engineering, Center for Optical Materials Science and Engineering Technologies (COMSET), Clemson University, Clemson, South Carolina 29670, United States
7. Department of Chemistry, University of Minnesota, Minneapolis, Minnesota 55455, United States
8. Halıcıŏglu Data Science Institute, University of California, San Diego, La Jolla, California 92093, United States
9. Mathematics and Computer Science Division, Argonne National Laboratory, Lemont, Illinois 60439, United States
10. Computer Science and Engineering Department, University of Connecticut, Storrs, Connecticut 06269-4155, United States