2 papers
physics.chem-ph2026
Local and Charge-Transfer Excitation of Pentacene-Buckminsterfullerene complexes
Ala Aldin M. Hani M. Darghouth, Omar A. Shareef, Firas A. AL-Lolage +1
The charge transfer state, the local excited state on pentacene, and the local excited state on buckminsterfullerene have been studied for four models of the pentacene-buckminsterf…
physics.chem-ph2024
Test of the Orbital-Based LI3 Index as a Predictor of the Height of the 3MLCT to 3MC Transition-State Barrier for [Ru(N N)3]2+ Polypyridine Complexes in CH3CN
Ala Aldin M. H. M. Darghouth, Denis Magero, Mark E. Casida
Ruthenium(II) polypyridine compounds often have a relatively long lived triplet metalligand charge transfer (3MLCT) state, making these complexes useful as chromophores for photoac…