Intramolecular Charge Transfer and Local Excitation in Organic Fluorescent Photoredox Catalysts Explained by RASCI-PDFT

Document Details

Document Type
Pub Defense Publication
Publication Date
May 14, 2018
Source ID
10.1021/acs.jpcc.8b01844

Entities

People

  • Davide Presti
  • Donald Truhlar
  • Laura Gagliardi

Organizations

  • Air Force Office of Scientific Research
  • University of Minnesota Supercomputing Institute