Search Results - "de Mendonça, João Paulo Almeida"

Origin of optical bandgap fluctuations in graphene oxide by de Lima, Alessandro Henrique, Tavares, Camila Thomacelli, da Cunha, Clemilda Corrêa Soares, Vicentini, Nayton Claudinei, Carvalho, Giovani Romeu, Fragneaud, Benjamin, Maciel, Indhira Oliveira, Legnani, Cristiano, Quirino, Welber Gianini, de Oliveira, Luiz Fernando Cappa, Sato, Fernando, de Mendonça, João Paulo Almeida

“…In this work, we explore the electrical, optical and spectroscopic properties of different Graphene Oxide (GO) samples focusing on new oxidative strategies to…”
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Artificial Neural Network-Based Density Functional Approach for Adiabatic Energy Differences in Transition Metal Complexes by de Mendonça, João Paulo Almeida, Mariano, Lorenzo Antonio, Devijver, Emilie, Jakse, Noel, Poloni, Roberta

“…During the past decades, approximate Kohn–Sham density functional theory schemes have garnered many successes in computational chemistry and physics, yet the…”
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High-Frequency Oscillator Based on Nano Graphene by de Mendonça, João Paulo Almeida, Silva, João Paulo Costa, Sato, Fernando

“…In this work, we propose an oscillator model based on carbon nanostructure. This model was built using three graphene sheets, in which the central sheet is…”
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Modeling surface energy in porous metallic nanostructures by de Mendonça, João Paulo Almeida, Monteiro, Maxwel Gama, de Andrade Leonel, Sidiney, Sato, Fernando

“…In this work we estimate surface energy values in nanostructures, with the use of a tight-binding potential with the second moment approximation. We propose a…”
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The Frogs Method: A Bioinspired Algorithm For Micromagnetic Dynamics Skyrmion Data Extraction by de Mendonça, João Paulo Almeida, Santece, Isaac Andrade, MonteiroJr, Maxwel Gama, Leonel, Sidiney Andrade, Coura, Pablo Zimmermann, Sato, Fernando

“…In this work we present a new bio-inspired method (using an adapted, frog based Particle Swarm Optimization) that can track a skyrmion's position. The…”
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Regression tree-based active learning by Jose, Ashna, de Mendonça, João Paulo Almeida, Devijver, Emilie, Jakse, Noël, Monbet, Valérie, Poloni, Roberta

“…Machine learning algorithms often require large training sets to perform well, but labeling such large amounts of data is not always feasible, as in many…”
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Digital Beings as an option to study gut flora evolution and adaptation by de Mendonça, João Paulo Almeida, Teixeira, Leonardo da Motta de Vasconcellos, Sato, Fernando

“…In this work, we introduce a computational model for the study of the host-bacteria interaction and the influence of the intestinal microbiota on the behavior…”
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Graphene oxide in water: a systematic computational experimental study by Ludwig, Valdemir, de Mendonça, João Paulo Almeida, de Lima, Alessandro Henrique, Da Costa Ludwig, Zélia Maria, Junqueira, Geórgia Maria Amaral, Quirino, Welber Gianini, Sato, Fernando

“…In this work, solvent effects on graphene oxide (GO) in liquid water were analyzed in terms of hydrogen bonds and electronic properties. The sequential Monte…”
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An Artificial Neural Network-based Density Functional Approach for Adiabatic Energy Differences in Transition Metal Complexes by de Mendonca, Joao Paulo Almeida, Mariano, Lorenzo A, Devijver, Emilie, Jakse, Noel, Poloni, Roberta

“…During the past decades, approximate Kohn-Sham density-functional theory schemes garnered many successes in computational chemistry and physics; yet the…”
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