QUÍMICA TEÓRICA Y COMPUTACIONAL
QTCOVI
University of Alberta
Edmonton, CanadáPublicaciones en colaboración con investigadores/as de University of Alberta (7)
2022
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Parallel versus Twisted Pentacenes: Conformational Impact on Singlet Fission
Journal of Physical Chemistry Letters, Vol. 13, Núm. 23, pp. 5094-5100
2020
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Laplacian of the Hamiltonian Kinetic Energy Density as an Indicator of Binding and Weak Interactions
ChemPhysChem, Vol. 21, Núm. 3, pp. 194-203
2019
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Intermolecular Singlet Fission in Unsymmetrical Derivatives of Pentacene in Solution
Advanced Energy Materials, Vol. 9, Núm. 2
2018
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Evidence for Charge-Transfer Mediation in the Primary Events of Singlet Fission in a Weakly Coupled Pentacene Dimer
Chem, Vol. 4, Núm. 5, pp. 1092-1111
2016
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Solution-based intramolecular singlet fission in cross-conjugated pentacene dimers
Nanoscale, Vol. 8, Núm. 19, pp. 10113-10123
2015
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Singlet fission in pentacene dimers
Proceedings of the National Academy of Sciences of the United States of America, Vol. 112, Núm. 17, pp. 5325-5330
1987
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THEORETICAL D-D SPECTRUM AND SPECTRAL PARAMETERS OF CRZ+(Z=1-4), MN-2+, AND V-2+ IN FLUORIDE LATTICES
CRYSTAL LATTICE DEFECTS AND AMORPHOUS MATERIALS, Vol. 15, Núm. 1-4, pp. 45-51