Visualitzant Departament de Química per matèria "Electrònica molecular"

Charge transfer in DNA: hole charge is confined to a single base pair due to solvation effects

Article open access ​

​

Estimates of electronic coupling for excess electron transfer in DNA

Article open access ​

​

Estimation of electronic coupling in π -stacked donor-bridge-acceptor systems: correction of the two-state model

Article open access ​

​

Two complementary molecular energy decomposition schemes: the Mayer and Ziegler-Rauk methods in comparison

Conformations of poly{G}-poly{C} π stacks with high hole mobility

Article open access ​

​

Electronic couplings and on-site energies for hole transfer in DNA: systematic quantum mechanical/molecular dynamic study

Article open access ​

​

Distance dependence of triplet energy transfer in water and organic solvents: A QM/MD study

Multiple Decay Mechanisms and 2D-UV Spectroscopic Fingerprints of Singlet Excited Solvated Adenine-Uracil Monophosphate

How Many Electrons Does a Molecular Electride Hold?