| Data de publicação | Data de defesa | Título | Autor(es) | Orientador(es) | Coorientador(es) |
| 2012 | - | Ab Initio correlated all electron Dirac-Fock calculations for eka-francium fluoride (E119F) | Miranda, Patrícia S.; Mendes, Anna Paula S.; Gomes, Jose S.; Alves, Claudio N.; Souza, Aguinaldo R. de; Sambrano, Julio R.; Gargano, Ricardo; Macedo, Luiz Guilherme M. de | - | - |
| 2020 | - | Accurate spectroscopic properties by diffusion quantum Monte Carlo calculations | Carvalho, Cassius Marcellus Costa; Gargano, Ricardo; Martins, João Batista Lopes; Politi, José Roberto dos Santos | - | - |
| 2019 | - | BTEX adsorption on TiO2 anatase and rutile surfaces : DFT functionals | Vargas, Marcos dos Reis; Castro, Elton Anderson Santos de; Politi, José Roberto dos Santos; Gargano, Ricardo; Martins, José Batista Lopes | - | - |
| 14-Fev-2019 | - | CO2 adsorption in nitrogen-doped single-layered graphene quantum dots : a spectroscopic investigation | Oliveira Neto, Pedro Henrique de; Rodrigues, João Paulo Caminha Cascudo; Sousa, Leonardo E. de; Gargano, Ricardo; Cunha, Wiliam Ferreira da | - | - |
| 22-Fev-2020 | - | Combining electronic properties and virtual screening for the development of new antioxidants : Trolox-like compounds as application example | Só, Yuri Alves de Oliveira; Silva, Mônica de Abreu; Carvalho, Fernando M.; Kiametis, Alessandra Sofia; Gargano, Ricardo | - | - |
| 28-Mai-2020 | - | Computational analysis of vibrational frequencies and rovibrational spectroscopic constants of hydrogen sulfide dimer using MP2 and CCSD(T) | Martins, João Batista Lopes; Quintino, Rabeshe P.; Politi, José Roberto dos Santos; Sethio, Daniel; Gargano, Ricardo; Krakab, Elfi | - | - |
| 24-Abr-2019 | - | Dynamics and spectroscopy of van der Waals complexes composed of ammonia and noble gases | Sette, Camila D’Avila Braga; Cunha, Thiago Ferreira da; Kiametis, Alessandra Sofia; Martins, João Batista Lopes; Gargano, Ricardo | - | - |
| 2020 | - | A first-principles study of the substitutional doping of the MgCl2 monolayer for spintronics applications | Lima, Igo Tôrres; Vasconcelos, Railson; Gargano, Ricardo; Paura, Edson Nunes Costa | - | - |
| 29-Mai-2020 | - | Hydrogen sulphide (H2S) and noble gases (Ng = He, Ne, Ar, Kr, Xe, Rn) complexes : a theoretical study of their dynamics, spectroscopy, and interactions | Oliveira, Alan Leone de Araújo; Silva, Mônica de Abreu; Pirani, Fernando; Macedo, Luiz Guilherme Machado de; Gargano, Ricardo | - | - |
| 2019 | - | Methanol, ethanol, propanol, and butanol adsorption on H-ZSM-5 zeolite : an ONIOM study | Costa, Rogério José da; Castro, Elton Anderson Santos de; Politi, José Roberto dos Santos; Gargano, Ricardo; Martins, João Batista Lopes | - | - |
| 2019 | - | Molecular modeling of cardanol-derived AChE inhibitors | Silva, Mônica de Abreu; Sette, Camila D’Avila Braga; Kiametis, Alessandra Sofia; Romeiro, Luiz Antonio Soares; Gargano, Ricardo | - | - |
| 11-Nov-2019 | - | Silicon carbide nanobelt : a novel molecule with potential technological application | Barbosa, Leonardo de Souza; Leal, Luciano Almeida; Gargano, Ricardo; Azevedo, David Lima | - | - |
| 5-Ago-2021 | - | Structural, theoretical and biological activity of mono and binuclear nickel(II) complexes with symmetrical and asymmetrical 4,6-diacetylresorcinol-dithiocarbazate ligands | Lima, Francielle Campos; Só, Yuri Alves de Oliveira; Gargano, Ricardo; Oliveira, Diêgo Madureira de; Gatto, Claudia Cristina | - | - |
| 2020 | - | Synthesis, theoretical calculation and anticancer activity of 4,6-diacetylresorcinol-dithiocarbazates and their Copper(II) complexes | Lima, Francielle Campos; Só, Yuri Alves de Oliveira; Gargano, Ricardo; Fujimori, Mahmi; França, Eduardo L.; França, Adenilda C. Honorio; Gatto, Claudia Cristina | - | - |
| 18-Jan-2019 | - | Theoretical investigation on H2O2-Ng (He, Ne, Ar, Kr, Xe, and Rn) complexes suitable for stereodynamics : interactions and thermal chiral rate consequences | Só, Yuri Alves de Oliveira; Oliveira Neto, Pedro Henrique de; Macedo, Luiz Guilherme Machado de; Gargano, Ricardo | - | - |
| 30-Abr-2019 | - | A theoretical study of adsorbed non-metallic atoms on magnesium chloride monolayers | Lima, Igo Tôrres; Gargano, Ricardo; Guerini, Silvete; Paura, Edson Nunes Costa | - | - |
