Browsing by Author Pires, Maíra dos Santos

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Showing results 1 to 6 of 6
Issue DateTitleAuthor(s)
21-Mar-2016Estrutura e reatividade da Maghemita dopada com Cu2+ em um sistema Fenton heterogêneo: aspectos teóricos e experimentaisPires, Maíra dos Santos
-Experimental and theoretical study on the reactivity of maghemite doped with Cu2+ in oxidation reactions: structural and thermodynamic properties towards a Fenton catalystPires, Maíra dos Santos; Nogueira, Francisco G. E.; Torres, Juliana A.; Lacerda, Lívia C. T.; Corrêa, Silviana; Pereira, Márcio C.; Ramalho, Teodorico C.
Aug-2015Molecular insight into the inhibition mechanism of plant and rat 4-hydroxyphenylpyruvate dioxygenase by molecular docking and DFT calculationsSilva, Telles Cardoso; Pires, Maíra dos Santos; Castro, Alexandre Alves de; Cunha, Elaine F. F. da; Caetano, Melissa Soares; Ramalho, Teodorico C.
May-2016Oxidative dehydration reaction of glycerol into acrylic acid: a first-principles prediction of structural and thermodynamic parameters of a bifunctional catalystLacerda, Lívia Clara T.; Pires, Maíra dos Santos; Corrêa, Silviana; Oliveira, Luiz Carlos A.; Ramalho, Teodorico C.
Nov-2018Structure and bonding in NbX5 X = (F, Cl, Br and I) complexes: a molecular orbital perspective in the C-H bond activationSilva, Telles Cardoso; Pires, Maíra dos Santos; Castro, Alexandre Alves de; Lacerda, Lívia Clara Tavares; Rocha, Marcus Vinícius Juliaci; Ramalho, Teodorico Castro
Feb-2017Theoretical structural and electronic analyses with emphasis on the reactivity of iron oxide prototypes in methane c-h bond activationSilva, Telles Cardoso; Almeida, Katia Júlia de; Pires, Maíra dos Santos; Castro, Alexandre Alves de; Gonçalves, Mateus Aquino; Cunha, Elaine Fontes Ferreira da; Ramalho, Teodorico Castro