Accurate Prediction of Vertical Emission from Excited-State Tuning of Range-Separated Density Functional Theory
Sign Up to like & getrecommendations! Published in 2020 at "Journal of Physical Chemistry C"
DOI: 10.1021/acs.jpcc.0c04885
Abstract: We report for the first time an excited-state (EX) tuning approach to accurately predict vertical emissions (VEs) based on the study of 36 medium and large organic molecules (∼66 heavy atoms) used ... read more here.
Keywords: excited state; state tuning; vertical emission; prediction vertical ... See more keywords