| Effects of temperature and electric field induced phase transitions on the dynamics of polarons and bipolarons LA Ribeiro, WF da Cunha, PH de Oliveria Neto, R Gargano, GM e Silva New Journal of Chemistry 37 (9), 2829-2836, 2013 | 57 | 2013 |
| A DFT study of the electronic, optical, and mechanical properties of a recently synthesized monolayer fullerene network RM Tromer, LAR Junior, DS Galvao Chemical Physics Letters 804, 139925, 2022 | 55 | 2022 |
| On the mechanical properties and thermal stability of a recently synthesized monolayer amorphous carbon LC Felix, RM Tromer, PAS Autreto, LA Ribeiro Junior, DS Galvao The Journal of Physical Chemistry C 124 (27), 14855-14860, 2020 | 47 | 2020 |
| Transport of polarons in graphene nanoribbons LA Ribeiro Jr, WF da Cunha, ALA Fonseca, GM e Silva, S Stafstrom The journal of physical chemistry letters 6 (3), 510-514, 2015 | 46 | 2015 |
| Polaron stability in molecular semiconductors: Theoretical insight into the impact of the temperature, electric field and the system dimensionality LAR Junior, S Stafström Physical Chemistry Chemical Physics 17 (14), 8973-8982, 2015 | 41 | 2015 |
| Mechanical, electronic, and optical properties of 8-16-4 graphyne: A 2d carbon allotrope with dirac cones RM Tromer, ML Pereira Júnior, KA L. Lima, AF Fonseca, LR da Silva, ... The Journal of Physical Chemistry C 127 (25), 12226-12234, 2023 | 40 | 2023 |
| Irida-graphene: A new 2d carbon allotrope MLP Júnior, WF da Cunha, WF Giozza, RT de Sousa Junior, LAR Junior FlatChem 37, 100469, 2023 | 40 | 2023 |
| Exciton dissociation and charge carrier recombination processes in organic semiconductors LA Ribeiro, PH Oliveira Neto, WF da Cunha, LF Roncaratti, R Gargano, ... The Journal of chemical physics 135 (22), 2011 | 40 | 2011 |
| Critical temperature and products of intrachain polaron recombination in conjugated polymers WF da Cunha, LAR Junior, R Gargano, GM e Silva Physical Chemistry Chemical Physics 16 (32), 17072-17080, 2014 | 35 | 2014 |
| On the mechanical properties and fracture patterns of the nonbenzenoid carbon allotrope (biphenylene network): a reactive molecular dynamics study ML Pereira, WF Da Cunha, RT De Sousa, GDA Nze, DS Galvão, ... Nanoscale 14 (8), 3200-3211, 2022 | 31 | 2022 |
| Thermal stability and fracture patterns of a recently synthesized monolayer fullerene network: A reactive molecular dynamics study LAR Junior, MLP Junior, WF Giozza, RM Tromer, DS Galvao Chemical Physics Letters 807, 140075, 2022 | 30 | 2022 |
| Bipolaron Dynamics in Graphene Nanoribbons GG Silva, LA Ribeiro Junior, ML Pereira Junior, AL de Almeida Fonseca, ... Scientific Reports 9, 2909, 2019 | 29* | 2019 |
| Kinetics of the OH+HCl→H2O+Cl reaction: Rate determining roles of stereodynamics and roaming and of quantum tunneling ND Coutinho, FO Sanches‐Neto, VH Carvalho‐Silva, HCB de Oliveira, ... Journal of Computational Chemistry 39 (30), 2508-2516, 2018 | 29 | 2018 |
| Impurity effects on polaron dynamics in graphene nanoribbons WF da Cunha, LAR Junior, AL de Almeida Fonseca, R Gargano, ... Carbon 91, 171-177, 2015 | 27 | 2015 |
| Impurity effects and temperature influence on the exciton dissociation dynamics in conjugated polymers LA Ribeiro, WF da Cunha, PHO Neto, R Gargano, GM e Silva Chemical Physics Letters 580, 108-114, 2013 | 24 | 2013 |
| Tuning penta-Graphene electronic properties through engineered Line Defects RM Santos, LE Sousa, DS Galvão, LA Ribeiro Scientific reports 10 (1), 8014, 2020 | 23 | 2020 |
| Impact of the electron–phonon coupling symmetry on the polaron stability and mobility in organic molecular semiconductors LA Ribeiro, S Stafström Physical Chemistry Chemical Physics 18 (3), 1386-1391, 2016 | 22 | 2016 |
| Impact of the electron–phonon interactions on the polaron dynamics in graphene nanoribbons AVP Abreu, JF Teixeira, ALA Fonseca, R Gargano, GM e Silva, LA Ribeiro The Journal of Physical Chemistry A 120 (27), 4901-4906, 2016 | 21 | 2016 |
| A dft study on the mechanical, electronic, thermodynamic, and optical properties of gan and aln counterparts of biphenylene network KAL Lima, LAR Junior Materials Today Communications 37, 107183, 2023 | 20 | 2023 |
| A DFT study of a set of natural dyes for organic electronics IT Lima, L Sousa, RS Freitas, LAR Junior, RT de Sousa Júnior, ... Journal of molecular modeling 23, 1-9, 2017 | 20 | 2017 |
Marcelo Lopes Pereira JúniorUniversidade de BrasíliaVerificeret mail på ene.unb.br