검색결과 : 4건
| No. | Article |
|---|---|
| 1 |
Revisiting the Tropospheric OH-Initiated Unimolecular Decomposition of Chlorpyrifos and Chlorpyrifos-Methyl: A Theoretical Perspective Quintano MM, Rodrigues GLS, Chagas MA, Rocha WR Journal of Physical Chemistry A, 124(21), 4280, 2020 |
| 2 |
Base Mechanism to the Hydrolysis of Phosphate Triester Promoted by the Cd2+/Cd2+ Active site of Phosphotriesterase: A Computational Study Chagas MA, Pereira ES, Godinho MPB, Da Silva JCS, Rocha WR Inorganic Chemistry, 57(10), 5888, 2018 |
| 3 |
Water Solvent Effect on Theoretical Evaluation of H-1 NMR Chemical Shifts: o-Methyl-Inositol Isomer Dos Santos HF, Chagas MA, De Souza LA, Rocha WR, De Almeida MV, Anconi CPA, De Almeida WB Journal of Physical Chemistry A, 121(14), 2839, 2017 |
| 4 |
Solvent effects on the metal-to-ligand charge transfer transition of the complex [Ru(NH3)(5)(Pyrazine)](2+) Chagas MA, Rocha WR Chemical Physics Letters, 612, 78, 2014 |