Orlando Roberto-Neto
Affiliations: | 1993 | Universidade de São Paulo (USP), São Paulo, São Paulo, Brazil |
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| Pontes MAP, Machado FBC, Roberto-Neto O, et al. (2020) Soot precursors in farnesane and n-dodecane decomposition: A computational approach Fuel. 268: 117334 |
| de Carvalho EFV, Vicentini GD, Alves TV, et al. (2019) Variational transition state theory rate constants and H/D kinetic isotope effects for CH + CH OCOH reactions. Journal of Computational Chemistry |
| Ferreira RM, Roberto-Neto O, Machado FBC, et al. (2019) Reply to Comment on "Thermochemical and Kinetics of the CHOH + (S)N Reactional System": The Role of Duplet Atomic Nitrogen. The Journal of Physical Chemistry. A |
| Ferreira RM, Roberto-Neto O, Machado FBC, et al. (2018) Thermochemical and Kinetcs of the CHOH + (S)N Reactional System. The Journal of Physical Chemistry. A |
| de Carvalho EFV, Roberto-Neto O. (2018) Effects of multidimensional tunneling in the kinetics of hydrogen abstraction reactions of O ( P) with CH OCHO. Journal of Computational Chemistry. 39: 1424-1432 |
| Roberto-Neto O, Alves TV. (2018) Multipath VTST rate constants for D + methyl formate reactions: Importance of torsional anharmonicity and conformational flexibility for combustion chemistry Chemical Physics Letters. 711: 132-137 |
| de Carvalho E, Lopez-Castillo A, Roberto-Neto O. (2018) A comparative study of the structures and electronic properties of graphene fragments: A DFT and MP2 survey Chemical Physics Letters. 691: 291-297 |
| Cardoso DV, Cunha LA, Spada RF, et al. (2016) Thermochemical and Kinetics of CH3SH + H Reactions: The Sensitivity of Coupling the Low and High-Level Methodologies. The Journal of Physical Chemistry. A |
| Duanmu K, Roberto-Neto O, Machado FBC, et al. (2016) Geometries, Binding Energies, Ionization Potentials, and Electron Affinities of Metal Clusters: Mgn0, ± 1, n = 1–7 The Journal of Physical Chemistry C. 120: 13275-13286 |
| Pelegrini M, Parreira RLT, Ferrão LFA, et al. (2016) Hydrazine decomposition on a small platinum cluster: the role of N2H5 intermediate Theoretical Chemistry Accounts. 135 |