Infrared Spectroscopy of Ethanethiol Monomers and Dimers at MP2 Level: Characterizing the Dimer Formation and Hydrogen Bond. - Airan F. S. Brito; Adélia J. A. Aquino; José Roberto dos Santos Politi; João B. L. Martins (J. Comput. Chem., 2025)

Exploring Mechanism and Kinetics of 1,4-Dioxane Oxidative Degradation by OH Radical: A Computational Quantum Chemistry Investigation. - Gustavo Gomes de Sousa; João B. L. Martins; José Roberto dos Santos Politi (J. Comput. Chem., 2025)