Llistar Títols per Autor "Voityuk, Alexander A."

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doc icon DUGiDocs 2008 Buckycatcher. A New Opportunity for Charge-Transfer Mediation? Voityuk, Alexander A. ; Duran i Portas, Miquel
doc icon DUGiDocs 2005 Charge transfer in DNA: hole charge is confined to a single base pair due to solvation effects Voityuk, Alexander A.
out url icon Recercat Charge transfer in DNA: hole charge is confined to a single base pair due to solvation effects Voityuk, Alexander A.
doc icon TDX 22 juny 2012 Computational modeling of charge transfer in nucleobase-aromatic amino acid complexes Butchosa Robles, Cristina
doc icon DUGiDocs 2008 Conformations of poly{G}-poly{C} π stacks with high hole mobility Voityuk, Alexander A.
out url icon Recercat Conformations of poly{G}-poly{C} π stacks with high hole mobility Voityuk, Alexander A.
doc icon DUGiDocs 2012 Distance dependence of triplet energy transfer in water and organic solvents: A QM/MD study Curutchet, Carles ; Voityuk, Alexander A.
doc icon DUGiDocs 21 novembre 2016 The Driving Force of Photoinduced Charge Separation in Metal-Cluster-Encapsulated Triphenylamine-[80]fullerenes Martínez, Juan Pablo ; Solà i Puig, Miquel ; Voityuk, Alexander A.
out url icon Recercat The Driving Force of Photoinduced Charge Separation in Metal-Cluster-Encapsulated Triphenylamine-[80]fullerenes Martínez, Juan Pablo ; Solà i Puig, Miquel ; Voityuk, Alexander A.
doc icon DUGiDocs 2008 Electronic couplings and on-site energies for hole transfer in DNA: systematic quantum mechanical/molecular dynamic study Voityuk, Alexander A.
out url icon Recercat Electronic couplings and on-site energies for hole transfer in DNA: systematic quantum mechanical/molecular dynamic study Voityuk, Alexander A.
doc icon DUGiDocs 2005 Estimates of electronic coupling for excess electron transfer in DNA Voityuk, Alexander A.
out url icon Recercat Estimates of electronic coupling for excess electron transfer in DNA Voityuk, Alexander A.
doc icon DUGiDocs 2014 Estimation of electronic coupling for singlet excitation energy transfer Voityuk, Alexander A.
doc icon DUGiDocs 2006 Estimation of electronic coupling in π -stacked donor-bridge-acceptor systems: correction of the two-state model Voityuk, Alexander A.
out url icon Recercat Estimation of electronic coupling in π -stacked donor-bridge-acceptor systems: correction of the two-state model Voityuk, Alexander A.
doc icon DUGiDocs 2014 Exciton delocalization, charge transfer, and electronic coupling for singlet excitation energy transfer between stacked nucleobases in DNA: An MS-CASPT2 study Blancafort San José, Lluís ; Voityuk, Alexander A.
out url icon Recercat Exciton delocalization, charge transfer, and electronic coupling for singlet excitation energy transfer between stacked nucleobases in DNA: An MS-CASPT2 study Blancafort San José, Lluís ; Voityuk, Alexander A.
doc icon DUGiDocs 2015 Extent of charge separation and exciton delocalization for electronically excited states in a triphenylamine-C60 donor–acceptor conjugate: a combined molecular dynamics and TD-DFT study Martínez, Juan Pablo ; Osuna Oliveras, Sílvia ; Solà i Puig, Miquel ; Voityuk, Alexander A.
doc icon DUGiDocs 2014 INDO/X: A new semiempirical method for excited states of organic and biological molecules Voityuk, Alexander A.
doc icon DUGiDocs 2015 Influence of base stacking geometry on the nature of excited states in G-quadruplexes: A time-dependent DFT study Lech, Christopher J. ; Phan, Anh Tuân ; Michel-Beyerle, Maria Elisabeth ; Voityuk, Alexander A.
doc icon DUGiDocs 2015 Interaction of Dark Excited States: Comparison of Computational Approaches Voityuk, Alexander A.
doc icon DUGiDocs 23 maig 2016 Multiple Decay Mechanisms and 2D-UV Spectroscopic Fingerprints of Singlet Excited Solvated Adenine-Uracil Monophosphate Li, Quansong ; Giussani, Angelo ; Segarra-Martí, Javier ; Nenov, Artur ; Rivalta, Ivan ; Voityuk, Alexander A. ; Mukamel, Shaul ; Roca-Sanjuán, Daniel ; Garavelli, Marco ; Blancafort San José, Lluís
out url icon Recercat Multiple Decay Mechanisms and 2D-UV Spectroscopic Fingerprints of Singlet Excited Solvated Adenine-Uracil Monophosphate Li, Quansong ; Giussani, Angelo ; Segarra-Martí, Javier ; Nenov, Artur ; Rivalta, Ivan ; Voityuk, Alexander A. ; Mukamel, Shaul ; Roca-Sanjuán, Daniel ; Garavelli, Marco ; Blancafort San José, Lluís
doc icon DUGiDocs 2014 On the performance of the Kohn-Sham orbital approach in the calculation of electron transfer parameters. the three state model Butchosa Robles, Cristina ; Simon i Rabasseda, Sílvia ; Blancafort San José, Lluís ; Voityuk, Alexander A.
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