White-light generation from all-solution-processed OLEDs using a benzothiazole–salophen derivative reactive to the ESIPT process LGTA Duarte, JC Germino, JF Berbigier, CA Barboza, MM Faleiros, ... Physical chemistry chemical physics 21 (3), 1172-1182, 2019 | 96 | 2019 |
A TD‐DFT basis set and density functional assessment for the calculation of electronic excitation energies of fluorene CA Barboza, PAM Vazquez, D Mac‐Leod Carey, R Arratia‐Perez International Journal of Quantum Chemistry 112 (20), 3434-3438, 2012 | 52 | 2012 |
A computational investigation on the antioxidant potential of myricetin 3,4′-di-O-α-L-rhamnopyranoside RA Mendes, SKC Almeida, IN Soares, CA Barboza, RG Freitas, A Brown, ... Journal of Molecular Modeling 24, 1-8, 2018 | 49 | 2018 |
Do double-hybrid exchange–correlation functionals provide accurate chemical shifts? A benchmark assessment for proton NMR MT de Oliveira, JMA Alves, AAC Braga, DJD Wilson, CA Barboza Journal of Chemical Theory and Computation 17 (11), 6876-6885, 2021 | 45 | 2021 |
Structural Correlations between Luminescent Properties and Excited State Internal Proton Transfer in Some Zinc(II) N,N′-Bis(salicylidenes) CA Barboza, JC Germino, AM Santana, FJ Quites, PAM Vazquez, ... The Journal of Physical Chemistry C 119 (11), 6152-6163, 2015 | 45 | 2015 |
Photoacidity as a tool to rationalize excited state intramolecular proton transfer reactivity in flavonols LGTA Duarte, JC Germino, C de Ávila Braga, CA Barboza, TDZ Atvars, ... Photochemical & Photobiological Sciences 17, 231-238, 2018 | 38 | 2018 |
Evaluation of the antioxidant potential of myricetin 3-O-α-L-rhamnopyranoside and myricetin 4′-O-α-L-rhamnopyranoside through a computational study RA Mendes, SKC Almeida, IN Soares, CA Barboza, RG Freitas, A Brown, ... Journal of molecular modeling 25 (4), 1-12, 2019 | 36 | 2019 |
Revealing the dynamic of excited state proton transfer of a π-conjugated salicylidene compound: An experimental and theoretical study MG Vivas, JC Germino, CA Barboza, DA Simoni, PAM Vazquez, ... The Journal of Physical Chemistry C 121 (2), 1283-1290, 2017 | 33 | 2017 |
Dual emissions of salicylidene-5-chloroaminepyridine due to excited state intramolecular proton transfer: dynamic photophysical and theoretical studies JC Germino, CA Barboza, FJ Quites, PAM Vazquez, TDZ Atvars The Journal of Physical Chemistry C 119 (49), 27666-27675, 2015 | 32 | 2015 |
An Ab initio study on the photophysics of tris (salicylideneaniline) CA Barboza, AL Sobolewski Physical Chemistry Chemical Physics 20 (39), 25164-25168, 2018 | 27 | 2018 |
Unravelling the ambiguity of the emission pattern of donor–acceptor salicylaldimines CA Barboza, O Morawski, J Olas, P Gawrys, M Banasiewicz, K Suwinska, ... Journal of Molecular Liquids 343, 117532, 2021 | 24 | 2021 |
Photophysical Transformations Induced by Chemical Substitution to Salicylaldimines CA Barboza, P Gawrys, M Banasiewicz, K Suwinska, AL Sobolewski Physical Chemistry Chemical Physics, 2020 | 24 | 2020 |
A relativistic study of the electronic and magnetic properties of cerocene and thorocene and its anions F Ferraro, CA Barboza, R Arratia-Pérez The Journal of Physical Chemistry A 116 (16), 4170-4175, 2012 | 21 | 2012 |
Excited-state and two-photon absorption in salicylidene molecules: the role of Zn (II) planarization MG Vivas, JC Germino, CA Barboza, PAM Vazquez, L De Boni, ... The Journal of Physical Chemistry C 120 (7), 4032-4039, 2016 | 19 | 2016 |
Theoretical study on the electronic excitations of a porphyrin-polypyridyl ruthenium (II) photosensitizer GI Cardenas-Jiron, CA Barboza, R López, MI Menéndez The Journal of Physical Chemistry A 115 (43), 11988-11997, 2011 | 19 | 2011 |
Substituent effects on the photophysical properties of tris (salicylideneanilines) CA Barboza, P Gawrys, M Banasiewicz, B Kozankiewicz, AL Sobolewski Physical Chemistry Chemical Physics 23, 1156-1164, 2021 | 15 | 2021 |
Electronic and magnetic properties of the [Ni (salophen)]: An experimental and DFT study RA Mendes, JC Germino, BR Fazolo, EHNS Thaines, F Ferraro, ... Journal of Advanced Research 9, 27-33, 2018 | 15 | 2018 |
Polarized helical coumarins:[1, 5] sigmatropic rearrangement and excited-state intramolecular proton transfer Ł Kielesiński, OW Morawski, CA Barboza, DT Gryko The Journal of Organic Chemistry 86 (9), 6148-6159, 2021 | 14 | 2021 |
Evidence of a photoinduced electron-transfer mechanism in the fluorescence self-quenching of 2, 5-substituted selenophenes prepared through in situ reduction of elemental … HD de Salles, FL Coelho, DB Paixao, CA Barboza, D da Silveira Rampon, ... The Journal of Organic Chemistry 86 (15), 10140-10153, 2021 | 13 | 2021 |
Conformation of the Ester Group Governs the Photophysics of Highly Polarized Benzo[g]coumarins K Szychta, B Koszarna, M Banasiewicz, A Sobolewski, O O’Mari, JA Clark, ... JACS Au 3 (7), 1918-1930, 2023 | 9 | 2023 |