Article ID Journal Published Year Pages File Type
5394748 Computational and Theoretical Chemistry 2012 11 Pages PDF
Abstract
► The computed SOC values are strong for the MECP. ► Intersystem crossing takes place with a large probability. ► The reactions are typical “two-state reactivity” (TSR) reaction. ► One transition state or intermediate does not determine the kinetics. ► TDTS (TOF-determining transition state) and the TDI (TOF-determining intermediate) are not adjacent.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Authors
, , , ,