Dr Neubi Xavier


Research Fellow
PhD

Academic and research departments

School of Chemistry and Chemical Engineering.

Publications

N. F. Xavier Jr., A. J. R. Payne, G. F. Bauerfeldt and M. Sacchi. Frontiers in Chemistry (2023) Theoretical insights into the methane catalytic decomposition on graphene nanoribbons edges.
N. F. Xavier Jr.*, G. F. Bauerfeldt and M. Sacchi. ACS Applied Materials & Interfaces (2023) First-Principles Microkinetic Modelling Unravelling the Performance of Edge-Decorated Nanocarbons for Hydrogen Production from Methane
A. Valbon, N. F. Xavier Jr., M. Carlos, G. Bauerfeldt, F. Almeida-Neto, P. de Lima Neto, M. Neves, C. Rodrigues-Santos, and A. Echevarria. Surfaces (2023) The Corrosion Inhibition Performance of Eco-Friendly bis-Schiff Bases on Carbon Steel in a Hydrochloric Solution
P. Maier., N. F. Xavier Jr., C. L. Truscott, T. Hansen, P. Fouquet, M. Sacchi, and A. Tamtögl. Physical Chemistry Chemical Physics (2022) How does tuning the van der Waals bonding strength affect adsorbate structure?
A. J. R. Payne, N. F. Xavier Jr., G. F. Bauerfeldt, and M. Sacchi. Physical Chemistry Chemical Physics (2022) Dehydrogenation of ammonia on free-standing and epitaxial hexagonal boron nitride
N. F. Xavier Jr., A. M. da Silva Jr., M. Sacchi, and G. F. Bauerfeldt. Monthly Notices of the Royal Astronomical Society (2022) Decarboxylation of glycine on icy grain surfaces: a first-principles investigation
N. F. Xavier Jr., and G. F. Bauerfeldt. Crystal Growth & Design (2021) Determination of the cohesive properties and sublimation temperature of glycine polymorphs
M. Carlos, N. F. Xavier Jr., A. da Silva Jr., M. Neves, A. Echevarria, and G. Bauerfeldt. Journal of the Brazilian Chemical Society (2021) Synergy between Experimental and Theoretical Investigations Reveals the Anti‑Corrosion Efficiency of Imine-Chalcones
D. N. de Jesus, J. M. B. A. da Silva, T. N. Tejero, G. S. Machado, N. F. Xavier Jr., and G. F. Bauerfeldt. Monthly Notices of the Royal Astronomical Society (2020) Chemical mechanism for the decomposition of CH3NH2 and implications to interstellar glycine
N. F. Xavier Jr., A. M. da Silva, and G. F. Bauerfeldt. Crystal Growth & Design (2020) What Rules the Relative Stability of α-, β-, and γ-Glycine Polymorphs?
N. F. Xavier Jr., A. M. Da Silva, and G. F. Bauerfeldt. Journal of Molecular Modelling (2019) Supercell calculations of the geometry and lattice energy of α-glycine crystal
N. F. Xavier Jr., L. Baptista, and G. F. Bauerfeldt. Monthly Notices of the Royal Astronomical Society (2019) Thermodynamic and kinetic aspects of glycine and its radical cation under interstellar medium conditions