| Theoretical study of the structural, energetic, and electronic properties of 55-atom metal nanoclusters: A DFT investigation within van der Waals corrections, spin–orbit … MJ Piotrowski, CG Ungureanu, P Tereshchuk, KEA Batista, AS Chaves, ... The Journal of Physical Chemistry C 120 (50), 28844-28856, 2016 | 108 | 2016 |
| Structure, Electronic, and Magnetic Properties of Binary PtnTM55–n (TM = Fe, Co, Ni, Cu, Zn) Nanoclusters: A Density Functional Theory Investigation D Guedes-Sobrinho, RK Nomiyama, AS Chaves, MJ Piotrowski, ... The Journal of Physical Chemistry C 119 (27), 15669-15679, 2015 | 95 | 2015 |
| Physical and Chemical Properties of Unsupported (MO2)n Clusters for M = Ti, Zr, or Ce and n = 1–15: A Density Functional Theory Study Combined with the Tree … L Zibordi-Besse, Y Seminovski, I Rosalino, D Guedes-Sobrinho, ... The Journal of Physical Chemistry C 122 (48), 27702-27712, 2018 | 52 | 2018 |
| Comparison of the performance of van der Waals dispersion functionals in the description of water and ethanol on transition metal surfaces RLH Freire, D Guedes-Sobrinho, A Kiejna, JLF Da Silva The Journal of Physical Chemistry C 122 (3), 1577-1588, 2018 | 52 | 2018 |
| Ab Initio Investigation of Atomistic Insights into the Nanoflake Formation of Transition-Metal Dichalcogenides: The Examples of MoS2, MoSe2, and MoTe2 NAMS Caturello, R Besse, ACH Da Silva, D Guedes-Sobrinho, MP Lima, ... The Journal of Physical Chemistry C 122 (47), 27059-27069, 2018 | 51 | 2018 |
| Theoretical investigation of the adsorption properties of CO, NO, and OH on monometallic and bimetallic 13-atom clusters: the example of Cu13, Pt7Cu6, and Pt13 AS Chaves, MJ Piotrowski, D Guedes-Sobrinho, JLF Da Silva The Journal of Physical Chemistry A 119 (47), 11565-11573, 2015 | 49 | 2015 |
| Nanocrystals self-assembled in superlattices directed by the solvent–organic capping interaction CJ Dalmaschio, EG da Silveira Firmiano, AN Pinheiro, DG Sobrinho, ... Nanoscale 5 (12), 5602-5610, 2013 | 38 | 2013 |
| Size-Induced Phase Evolution of MoSe2 Nanoflakes Revealed by Density Functional Theory R Besse, NAMS Caturello, CMO Bastos, D Guedes-Sobrinho, MP Lima, ... The Journal of Physical Chemistry C 122 (35), 20483-20488, 2018 | 34 | 2018 |
| Relativistic DFT-1/2 calculations combined with a statistical approach for electronic and optical properties of mixed metal hybrid perovskites D Guedes-Sobrinho, I Guilhon, M Marques, L K. Teles The Journal of Physical Chemistry Letters 10 (15), 4245-4251, 2019 | 29 | 2019 |
| Ab Initio Investigation of the Role of CO Adsorption on the Physical Properties of 55-Atom PtCo Nanoalloys D Guedes-Sobrinho, RLH Freire, AS Chaves, JLF Da Silva The Journal of Physical Chemistry C 121 (49), pp 27721-27732, 2017 | 19 | 2017 |
| Thermodynamic Stability and Structural Insights for CH3NH3Pb1−xSixI3, CH3NH3Pb1−xGexI3, and CH3NH3Pb1−xSnxI3 Hybrid Perovskite Alloys: A Statistical Approach from First … D Guedes-Sobrinho, I Guilhon, M Marques, LK Teles Scientific Reports 9 (11061), 1, 2019 | 18 | 2019 |
| Bulk Rashba effect splitting and suppression in polymorphs of metal iodine perovskites L Octavio de Araujo, FP Sabino, CRC Rego, D Guedes-Sobrinho The Journal of Physical Chemistry Letters 12 (30), 7245-7251, 2021 | 16 | 2021 |
| Density functional investigation of the adsorption effects of PH3 and SH2 on the structure stability of the Au55 and Pt55 nanoclusters D Guedes-Sobrinho, AS Chaves, MJ Piotrowski, JLF Da Silva The Journal of Chemical Physics 146 (16), 2017 | 13 | 2017 |
| Impact of the polymorphism and relativistic effects on the electronic properties of inorganic metal halide perovskites L Octavio de Araujo, CRC Rêgo, W Wenzel, FP Sabino, ... The Journal of Physical Chemistry C 126 (4), 2131-2140, 2022 | 11 | 2022 |
| (Meta-) stability and Core–Shell Dynamics of Gold Nanoclusters at Finite Temperature D Guedes-Sobrinho, W Wang, IP Hamilton, JLF Da Silva, LM Ghiringhelli The Journal of Physical Chemistry Letters 10 (3), 685-692, 2019 | 10 | 2019 |
| Molecular adsorption on coinage metal subnanoclusters: A DFT+ D3 investigation JPCS Felix, KEA Batista, WO Morais, GR Nagurniak, RP Orenha, ... Journal of Computational Chemistry 44 (10), 1040-1051, 2023 | 8 | 2023 |
| Assessment of the van der Waals, Hubbard U parameter and spin‐orbit coupling corrections on the 2D/3D structures from metal gold congeners clusters MJ Piotrowski, RP Orenha, RLT Parreira, D Guedes‐Sobrinho Journal of Computational Chemistry 43 (4), 230-243, 2022 | 8 | 2022 |
| The effect of different energy portions on the 2D/3D stability swapping for 13-atom metal clusters D Guedes-Sobrinho, RP Orenha, RLT Parreira, GR Nagurniak, ... Physical Chemistry Chemical Physics 24 (11), 6515-6524, 2022 | 6 | 2022 |
| Influence of electrosynthesis methods in the electrocatalytical and morphological properties of cobalt and nickel hexacyanoferrate films TS Rossi, LN Tenorio, D Guedes-Sobrinho, H Winnischofer, M Vidotti Electrochimica Acta 361, 137021, 2020 | 6 | 2020 |
| How cation nature controls the bandgap and bulk Rashba splitting of halide perovskites LO de Araujo, CRC Rêgo, W Wenzel, DN Silveira, MJ Piotrowski, ... Journal of Computational Chemistry 44 (14), 1395-1403, 2023 | 5 | 2023 |
Maurício Jeomar PiotrowskiProfessor de Física, Universidade Federal de PelotasPreverjeni e-poštni naslov na ufpel.edu.br
