Search Results - "Ferreira de Morais, Rodrigo"

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  1. 1

    Force Field for Water over Pt(111): Development, Assessment, and Comparison by Steinmann, Stephan N, Ferreira De Morais, Rodrigo, Götz, Andreas W, Fleurat-Lessard, Paul, Iannuzzi, Marcella, Sautet, Philippe, Michel, Carine

    Published in Journal of chemical theory and computation (12-06-2018)
    “…Metal/water interfaces are key in many natural and industrial processes, such as corrosion, atmospheric, or environmental chemistry. Even today, the only…”
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    Journal Article
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    How Does the Surface Structure of Pt–Ni Alloys Control Water and Hydrogen Peroxide Formation? by Ferreira de Morais, Rodrigo, Franco, Alejandro A, Sautet, Philippe, Loffreda, David

    Published in ACS catalysis (02-09-2016)
    “…Polymer electrolyte membrane fuel cells have been studied for more than three decades as promising clean energy converters for automotive applications…”
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    Journal Article
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    A multiscale theoretical methodology for the calculation of electrochemical observables from ab initio data: Application to the oxygen reduction reaction in a Pt(1 1 1)-based polymer electrolyte membrane fuel cell by de Morais, Rodrigo Ferreira, Sautet, Philippe, Loffreda, David, Franco, Alejandro A.

    Published in Electrochimica acta (01-12-2011)
    “…In this work we present a multiscale theoretical methodology that scales up ab initio calculated data into elementary kinetic models in order to simulate…”
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    Journal Article Conference Proceeding
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    Capturing Solvation Effects at a Liquid/Nanoparticle Interface by Ab Initio Molecular Dynamics: Pt 201 Immersed in Water by de Morais, Rodrigo Ferreira, Kerber, Torsten, Calle-Vallejo, Federico, Sautet, Philippe, Loffreda, David

    “…Solvation can substantially modify the adsorption properties of heterogeneous catalysts. Although essential for achieving realistic theoretical models,…”
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    Journal Article
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    Interplay between Reaction Mechanism and Hydroxyl Species for Water Formation on Pt(111) by Ferreira de Morais, Rodrigo, Franco, Alejandro A, Sautet, Philippe, Loffreda, David

    Published in ACS catalysis (06-02-2015)
    “…Predicting the reaction mechanism of water and hydrogen peroxide formation on a platinum catalyst is a crucial step toward the understanding of the…”
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    Journal Article
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    Molecular mechanics models for the image charge, a comment on “including image charge effects in the molecular dynamics simulations of molecules on metal surfaces” by Steinmann, Stephan N., Fleurat‐Lessard, Paul, Götz, Andreas W., Michel, Carine, Ferreira de Morais, Rodrigo, Sautet, Philippe

    Published in Journal of computational chemistry (15-09-2017)
    “…We re‐investigate the image charge model of Iori and Corni (Iori and Corni, J. Comput. Chem. 2008, 29, 1656). We find that a simple symmetrization of their…”
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    Journal Article
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    Conhecimento ecológico tradicional da comunidade de Limpo Grande sobre a vegetação, Várzea Grande, Mato Grosso, Brasil by Rodrigo Ferreira de Morais, Cintia Silva Serrano, Fernando Ferreira de Morais

    “…O estudo foi conduzido na comunidade de Limpo Grande, localizada a 23 km do município de Várzea Grande, Mato Grosso. Para verificar a possibilidade de os…”
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    Journal Article
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    Dung beetles (Coleoptera: Scarabaeinae) in a mosaic habitat at the ecotone between two savanna ecosystems in the Neotropical region by Salomão, Renato Portela, Gonçalves, Lucas Kaique Sousa, de Morais, Rodrigo Ferreira, Lima, Lucas Ramos Costa

    “…One of the main issues related to the conservation of native ecosystems involves the availability of data regarding the biodiversity present on them. In…”
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    Journal Article
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    Occurrence of Mormolyca cleistogama (Maxillarinae, Orchidaceae) in São Paulo state, Brazil by Marcusso, Gabriel Mendes, Parra-Sanchez, Edicson, Morais, Rodrigo Ferreira de

    Published in Rodriguésia (01-06-2018)
    “…Abstract Mormolyca cleistogama has its occurrence unknown in São Paulo state, although widely distributed in South America. In this study, based in field…”
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    Journal Article
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    Composição florística e estrutura da comunidade vegetal em diferentes fitofisionomias do Pantanal de Poconé, Mato Grosso by Rodrigo Ferreira de Morais, Edna Cavalcante Saraiva da Silva, Mariana Regina Lema Metelo, Fernando Ferreira de Morais

    Published in Rodriguésia (01-12-2013)
    “…Esta pesquisa teve como objetivo analisar a composição e estrutura de comunidade vegetal de quatro fitofisionomias no Pantanal de Poconé, estado de Mato…”
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    Journal Article
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    Controlling the spectroscopic parameters of Er3+-doped sodium silicate glass by tuning the Er2O3 and Na2O concentrations by Serqueira, Elias Oliveira, de Morais, Rodrigo Ferreira, Dantas, Noelio Oliveira

    Published in Journal of alloys and compounds (25-05-2013)
    “…► We studied the influence Er2O3 and Na2O on optical properties of silicate glass. ► The glass system were synthesized by fusion method. ► The change in…”
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    Journal Article
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    Capturing Solvation Effects at a Liquid/Nanoparticle Interface by Ab Initio Molecular Dynamics: Pt201 Immersed in Water by de Morais, Rodrigo Ferreira, Kerber, Torsten, Calle-Vallejo, Federico, Sautet, Philippe, Loffreda, David

    “…Solvation can substantially modify the adsorption properties of heterogeneous catalysts. Although essential for achieving realistic theoretical models,…”
    Get full text
    Journal Article
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    Capturing Solvation Effects at a Liquid/Nanoparticle Interface by Ab Initio Molecular Dynamics: Pt sub(201) Immersed in Water by de Morais, Rodrigo Ferreira, Kerber, Torsten, Calle-Vallejo, Federico, Sautet, Philippe, Loffreda, David

    “…Solvation can substantially modify the adsorption properties of heterogeneous catalysts. Although essential for achieving realistic theoretical models,…”
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    Journal Article
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    Conhecimento ecológico tradicional sobre plantas cultivadas pelos pescadores da comunidade Estirão Comprido, Pantanal matogrossense, Brasil by Fernando Ferreira de Morais, Rodrigo Ferreira de Morais, Carolina Joana da Silva

    “…Esta pesquisa situa-se no campo da etnoecologia e aborda o conhecimento ecológico tradicional (CET) sobre plantas cultivadas na comunidade de Estirão Comprido,…”
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    Journal Article
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    Conhecimento ecológico tradicional da comunidade de Limpo Grande sobre a vegetação, Várzea Grande, Mato Grosso, Brasil by Morais, Rodrigo Ferreira de, Serrano, Cintia Silva, Morais, Fernando Ferreira de

    “…O estudo foi conduzido na comunidade de Limpo Grande, localizada a 23 km do município de Várzea Grande, Mato Grosso. Para verificar a possibilidade de os…”
    Get full text
    Journal Article
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    Chuva de sementes em uma região ecotonal entre Cerrado e Caatinga no Piauí, Brasil by Morais, Rodrigo Ferreira de, Macedo, Maria Thamiris de Sousa Macedo, Ibiapina, Ronaldo de Araújo, Santiago Junior, Luiz Carlos, Teixeira, Jefferson da Silva, Morais, Fernando Ferreira de, Sousa Júnior, José Ribamar

    Published in Ciência florestal (24-06-2022)
    “…A investigação da chuva de sementes pode fornecer informações úteis sobre a distribuição espacial, densidade e riqueza das espécies. O objetivo deste trabalho…”
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    Journal Article