Tuning penta-Graphene electronic properties through engineered Line Defects RM Santos, LE Sousa, DS Galvão, LA Ribeiro Scientific reports 10 (1), 8014, 2020 | 26 | 2020 |
Theoretical Investigation of the Role of Mixed A Cations in the Structure, Stability, and Electronic Properties of Perovskite Alloys RM dos Santos, IO Cruz, AC Dias, MP Lima, JLFD Silva ACS Appl. Energy Mater., 2023 | 13 | 2023 |
Tuning the electronic structure properties of MoS 2 monolayers with carbon doping WF da Cunha, RM Dos Santos, RT de Sousa Júnior, RB Santos, ... Physical Chemistry Chemical Physics 21 (21), 11168-11174, 2019 | 12 | 2019 |
On the adsorption mechanism of caffeine on mapbi 3 perovskite surfaces: A combined umc-dft study LAR Junior, RM Tromer, RM Dos Santos, DS Galvao Physical chemistry chemical physics 23 (18), 10807-10813, 2021 | 10 | 2021 |
Tuning magnetic properties of penta-graphene bilayers through doping with boron, nitrogen, and oxygen RM Santos, WF da Cunha, RT de Sousa Junior, WF Giozza, ... Scientific Reports 10 (1), 16748, 2020 | 9 | 2020 |
Defective graphene domains in boron nitride sheets RM Dos Santos, RB Santos, BGE Neto, GME Silva, LAR Junior Journal of molecular modeling 25, 1-6, 2019 | 8 | 2019 |
Electronic and structural properties of vacancy endowed BCN heterostructures RM dos Santos, AL de Aguiar, LAR Junior, J da Rocha Martins Chemical Physics Letters 724, 103-109, 2019 | 7 | 2019 |
Electronic and Structural Properties of Janus SMoSe/MoX (X= S, Se) In-plane Heterojunctions: A DFT Study RM Santos, WF da Cunha, WF Giozza, RT Júnior, LFR Júnior, LAR Júnior Chemical Physics Letters, 2021 | 5 | 2021 |
Structural and electronic properties of defective AlN/GaN hybrid nanostructures RM dos Santos, AL de Aguiar, J da Rocha Martins, RB dos Santos, ... Computational materials science 183, 109860, 2020 | 5 | 2020 |
Contrasting the stability, octahedral distortions, and optoelectronic properties of 3D MABX 3 and 2D (BA) 2 (MA) B 2 X 7 (B= Ge, Sn, Pb; X= Cl, Br, I) perovskites JG Danelon, RM Santos, AC Dias, JLF Da Silva, MP Lima Physical Chemistry Chemical Physics 26 (10), 8469-8487, 2024 | 4 | 2024 |
Predicting the Energetic Stabilization of Janus-MoSSe/AlN Heterostructures: A DFT Study RM Santos, MLP Junior, LFR Junior, LAR Junior Chemical Physics Letters, 2021 | 4 | 2021 |
A DFT study on the electronic structure of in-plane heterojunctions of graphene and hexagonal boron nitride nanoribbons RM dos Santos, WF Giozza, RT de Sousa Junior, DA da Silva Filho, ... Electronic Structure 3 (2), 024005, 2021 | 2 | 2021 |
On the Electronic Structure of a Recently Synthesized Graphene-like BCN Monolayer from bis-BN Cyclohexane: A DFT Study RM Santos, WF Giozza, RT Júnior, LAR Júnior Electronic Structure, 2021 | 1 | 2021 |
Cubic-to-hexagonal structural phase transition in metal halide compounds: a DFT study I Ornelas-Cruz, RM dos Santos, JE González, MP Lima, JLF Da Silva Journal of Materials Chemistry A 12 (21), 12564-12580, 2024 | | 2024 |
Estudo das propriedades eletrônicas de nanomateriais 2D na presença de defeitos estruturais RM Santos | | 2021 |
PROPRIEDADES ESTRUTURAIS E ELETRÔNICA DE MONOCAMADAS DE BCN COM PRESENÇA DE MONOVACÂNCIAS. RM SANTOS | | 2018 |
Supplementary Information: Contrasting the Stability, Octahedral Distortions and Optoelectronic Properties of 2D and 3D MABX3 (B= Ge, Sn, Pb; X= Cl, Br, I) Perovskites. JG Danelon, RM Santos, AC Dias, J LF | | |
Supporting Information: Theoretical Investigation of the Role of Mixed A Cations in the Structure, Stability and Electronic Properties of Perovskite Alloys RM dos Santos, I Ornelas–Cruz, AC Dias, MP Lima, JLF Da Silva | | |