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Results 1-10 of 12 (Search time: 0.006 seconds).
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Issue DateData de defesaTitleAuthor(s)Orientador(es)Coorientador(es):
2020-A first-principles study of the substitutional doping of the MgCl2 monolayer for spintronics applicationsLima, Igo Tôrres; Vasconcelos, Railson; Gargano, Ricardo; Paura, Edson Nunes Costa--
28-May-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--
29-May-2020-Hydrogen sulphide (H2S) and noble gases (Ng = He, Ne, Ar, Kr, Xe, Rn) complexes : a theoretical study of their dynamics, spectroscopy, and interactionsOliveira, Alan Leone de Araújo; Silva, Mônica de Abreu; Pirani, Fernando; Macedo, Luiz Guilherme Machado de; Gargano, Ricardo--
14-Feb-2019-CO2 adsorption in nitrogen-doped single-layered graphene quantum dots : a spectroscopic investigationOliveira Neto, Pedro Henrique de; Rodrigues, João Paulo Caminha Cascudo; Sousa, Leonardo E. de; Gargano, Ricardo; Cunha, Wiliam Ferreira da--
2020-Accurate spectroscopic properties by diffusion quantum Monte Carlo calculationsCarvalho, Cassius Marcellus Costa; Gargano, Ricardo; Martins, João Batista Lopes; Politi, José Roberto dos Santos--
2019-Molecular modeling of cardanol-derived AChE inhibitorsSilva, Mônica de Abreu; Sette, Camila D’Avila Braga; Kiametis, Alessandra Sofia; Romeiro, Luiz Antônio Soares; Gargano, Ricardo--
18-Jan-2019-Theoretical investigation on H2O2-Ng (He, Ne, Ar, Kr, Xe, and Rn) complexes suitable for stereodynamics : interactions and thermal chiral rate consequencesSó, Yuri Alves de Oliveira; Oliveira Neto, Pedro Henrique de; Macedo, Luiz Guilherme Machado de; Gargano, Ricardo--
2020-Synthesis, theoretical calculation and anticancer activity of 4,6-diacetylresorcinol-dithiocarbazates and their Copper(II) complexesLima, Francielle Campos; Só, Yuri Alves de Oliveira; Gargano, Ricardo; Fujimori, Mahmi; França, Eduardo L.; França, Adenilda C. Honorio; Gatto, Claudia Cristina--
11-Nov-2019-Silicon carbide nanobelt : a novel molecule with potential technological applicationBarbosa, Leonardo de Souza; Leal, Luciano Almeida; Gargano, Ricardo; Azevedo, David Lima--
24-Apr-2019-Dynamics and spectroscopy of van der Waals complexes composed of ammonia and noble gasesSette, Camila D’Avila Braga; Cunha, Thiago Ferreira da; Kiametis, Alessandra Sofia; Martins, João Batista Lopes; Gargano, Ricardo--