Comparison of the non-radiative decay mechanisms of 4-pyrimidinone and uracil: an ab initio study†
Abstract
We performed a comparative theoretical study of the relaxation mechanisms of the excited states of C (for
N (for
C twisting is hindered by a barrier. The relaxed scan of the C
N double-bond twisting of
- This article is part of the themed collection: Molecular mechanisms of the photostability of life