ListarDepartament de Química por tema "Electrònica molecular"

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

Artículo open access ​

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Estimates of electronic coupling for excess electron transfer in DNA

Artículo open access ​

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

Artículo open access ​

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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

Artículo open access ​

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

Artículo open access ​

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

Artículo embargoed access ​

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

How Many Electrons Does a Molecular Electride Hold?