| Investigation of electronic transport under mechanical strain in a molecular junction composed of a polyyne bridge connected to SWCNT electrodes SM Corrêa, DFS Ferreira, MRS Siqueira, JC Reis-Silva, JFP Leal, ... Physical Chemistry Chemical Physics 19 (33), 22078-22087, 2017 | 17 | 2017 |
| Single-molecular diodes based on opioid derivatives MRS Siqueira, SM Corrêa, RM Gester, J Del Nero, A Neto Journal of molecular modeling 21, 1-9, 2015 | 15 | 2015 |
| Combined approach using clustering-random forest to evaluate partial discharge patterns in hydro generators ACN Pardauil, TP Nascimento, MRS Siqueira, UH Bezerra, WD Oliveira Energies 13 (22), 5992, 2020 | 14 | 2020 |
| Stability, edge passivation effect, electronic and transport properties of POPGraphene nanoribbons EAV Mota, M Moura-Moreira, MRS Siqueira, CAB da Silva, J Del Nero Physical Chemistry Chemical Physics 23 (3), 2483-2490, 2021 | 13 | 2021 |
| Isomeric effects tuning the electron transport in carotenoid derivatives: from ohmic to rectifier behavior AM Guedes, SM Corrêa, DFS Ferreira, MRS Siqueira, RM Gester, A Neto, ... Journal of molecular modeling 24, 1-9, 2018 | 11 | 2018 |
| Electron scattering processes in steroid molecules via NEGF-DFT: the opening of conduction channels by central oxygen DFS Ferreira, WD Oliveira, E Belo, R Gester, MRS Siqueira, AMJC Neto, ... Journal of Molecular Graphics and Modelling 101, 107755, 2020 | 8 | 2020 |
| A DFT analysis of electronic, reactivity, and NLO responses of a reactive orange dye: the role of Hartree-Fock exchange corrections S Fonseca, L Santos, R Pereira, L Modesto-Costa, AR da Cunha, ... Journal of Molecular Modeling 28 (4), 85, 2022 | 5 | 2022 |
| Oseltamivir, uma correlação de deslocamento químico de 13C LB Wulff, G da Silva Prado, TF Giacomello, MRS Siqueira, ... Brazilian Journal of Development 5 (12), 32129-32135, 2019 | 4 | 2019 |
| Modulation of the NLO properties of p-coumaric acid by the solvent effects and proton dissociation MVA Damasceno, AR Cunha, PF Provasi, GI Pagola, M Siqueira, ... Journal of Molecular Liquids 394, 123587, 2024 | 3 | 2024 |
| Role of the Solvent and Intramolecular Hydrogen Bonds in the Antioxidative Mechanism of Prenylisoflavone from Leaves of Vatairea guianensis S Fonseca, NSS Dos Santos, A Torres, M Siqueira, A da Cunha, ... The Journal of Physical Chemistry A 127 (51), 10807-10816, 2023 | 3 | 2023 |
| Electronic confinement in α-pho-graphene devices by hydrogenation and width effect consonance DFS Ferreira, WD Oliveira, MRS Siqueira, CAB Silva Jr, J Del Nero Materials Letters 347, 134609, 2023 | 3 | 2023 |
| SARS-CoV-2 external structures interacting with nanospheres using docking and molecular dynamics AY Martins da Silva, TS Arouche, MRS Siqueira, TC Ramalho, ... Journal of Biomolecular Structure and Dynamics, 1-16, 2023 | 3 | 2023 |
| Assessing the dipolar-octupolar NLO behavior of substituted thiosemicarbazone assemblies R Gester, M Siqueira, AR Cunha, RS Araújo, PF Provasi, S Canuto Chemical Physics Letters 831, 140807, 2023 | 2 | 2023 |
| Biotransformation of 1-nitro-2-phenylethane 2-phenylethanol from fungi species of the Amazon biome: an experimental and theoretical analysis NSS Dos Santos, S Fonseca, FF Almeida, E Belo, M Siqueira, ... Journal of Molecular Modeling 29 (8), 223, 2023 | 1 | 2023 |
| Oscilador harmônico simples, série e transformada de Fourier e operador de Sturm-Liouville–uma breve discussão LS Barros, M Cavalcante, P Soledade, DA Sbrissa, M Siqueira Revista Brasileira de Ensino de Física 45, e20230046, 2023 | 1 | 2023 |
| Computational applications in physics: Spectral representation of Green’s function with Python ÉL Pinheiro, KM Barata, OJ Nascimento Neto, RS Martins, MRS Siqueira Revista Brasileira de Ensino de Física 46, e20240011, 2024 | | 2024 |
| Aplicações computacionais em física: Representação espectral da função de Green com Python ÉL Pinheiro, KM Barata, OJ Nascimento, RS Martins, MRS Siqueira Revista Brasileira de Ensino de Física 46, e20240011, 2024 | | 2024 |
| Fatores de Escalonamento de Δ de RMN de 13C: Comparação de Diferentes Funcionais Híbridos e Conjuntos de Funções de Base FLP Costa, GVS Mota, M Siqueira, AMJC Neto Revista Processos Químicos 18 (35), 51-55, 2024 | | 2024 |
| Simple Harmonic Oscillator, Series, and Fourier Transform and Sturm-Liouville Operator–A Brief Discussion LS Barros, M Cavalcante, P Soledade, DA Sbrissa Neto, M Siqueira Revista Brasileira de Ensino de Física 45, e20230046, 2023 | | 2023 |
| Nickel ion removal system using activated carbon: A theoretical investigation NML Gester, TA da Silva, JD Oliveira, RIS Santos, MRS Siqueira, ... Computational and Theoretical Chemistry 1221, 114055, 2023 | | 2023 |
Rodrigo GesterUniversidade Federal do Sul e Sudeste do Pará在 unifesspa.edu.br 的电子邮件经过验证
