| Theoretical Model of Polarization Effects on Third-Order NLO Properties of the Stilbazolium Derivative Crystal MR Barbosa, ISD Costa, TO Lopes, C Valverde, DFS Machado, ... The Journal of Physical Chemistry A 126 (48), 8901-8909, 2022 | 7 | 2022 |
| Non-covalent interactions and their impact on the complexation thermodynamics of noble gases with methanol LR Vieira, SF de Brito, MR Barbosa, TO Lopes, DFS Machado, ... Physical Chemistry Chemical Physics 22 (30), 17171-17180, 2020 | 7 | 2020 |
| Tratamento explícito do efeito de solvente nas propriedades de óptica não-linear em derivados de chalconas utilizando a metodologia QM/MM sequencial MR Barbosa | 1 | 2021 |
| Cover Feature: Deciphering Stereoselectivity in Hurd‐Claisen Rearrangements: A Comprehensive Study of Electrostatic Interactions from Shubin's Energy Decomposition Analysis … AGC Oliveira, MR Barbosa, PHF Matias, CAL Silva, DFS Machado, ... ChemPhysChem 25 (19), e202481903, 2024 | | 2024 |
| Deciphering Stereoselectivity in Hurd‐Claisen Rearrangements: A Comprehensive Study of Electrostatic Interactions from Shubin's Energy Decomposition Analysis AGC Oliveira, MR Barbosa, PHF Matias, CAL Silva, DFS Machado, ... ChemPhysChem 25 (19), e202400565, 2024 | | 2024 |
| (Ro) vibrational Spectroscopic Constants, Lifetime and QTAIM Evaluation of Fullerene Dimers Stability RA Lemos Silva, MR Barbosa, CR Martins, DF Scalabrini Machado, ... Molecules 28 (13), 5023, 2023 | | 2023 |
Heibbe Cristhian B. de OliveiraInstituto de Química - Universidade de Brasília在 unb.br 的电子邮件经过验证
