Reactivity of eumelanin building blocks: A DFT study of monomers and dimers GGB Alves, FC Lavarda, CFO Graeff, A Batagin-Neto Journal of Molecular Graphics and Modelling 98, 107609, 2020 | 26 | 2020 |
Molecular modeling of low bandgap diblock co-oligomers with π-bridges for applications in photovoltaics GGB Alves, EF Oliveira, A Batagin-Neto, FC Lavarda Computational Materials Science 152, 12-19, 2018 | 9 | 2018 |
Local Reactivity on Carbon Quantum Dots: The Influence of the Geometries and Chemical Doping for Chemical Sensor Applications G GB Alves, A Batagin-Neto The Journal of Physical Chemistry C 127 (7), 3819-3829, 2023 | 2 | 2023 |
Sulfonated melanin derivatives: theoretical evaluation of local reactivities and chemical structures JPB Cuba, GGB Alves, LA Galindo, JV Paulin, A Batagin-Neto Journal of Molecular Modeling 27, 1-8, 2021 | 2 | 2021 |
Challenges in surface‐enhanced Raman scattering signal for ethephon detection: Theoretical and experimental approaches I Bianchi‐Carvalho, CS Martin, GGB Alves, JN Silva, A Batagin‐Neto, ... Journal of Raman Spectroscopy 55 (1), 75-85, 2024 | | 2024 |
Interaction between components of polymeric light emitting electrochemical cells: A DFT case study for MDMO-PPV/KCF3SO3/PEO system LA Galindo, GGB Alves, FC Lavarda, A Batagin-Neto Computational Materials Science 230, 112514, 2023 | | 2023 |
Estudo de reatividade de materiais orgânicos: síntese de melanina e sensores químicos baseados em nanoflakes de carbono. GGB Alves Universidade Estadual Paulista (Unesp), 2020 | | 2020 |