Marcos Rellán‐Piñeiro

发表

Developments in the Atomistic Modelling of Catalytic Processes for the Production of Platform Chemicals from Biomass

N. López, Rodrigo Garcı́a-Muelas, Marcos Rellán‐Piñeiro, 2018, ChemCatChem.

Quasi-degenerate states and their dynamics in oxygen deficient reducible metal oxides.

N. López, F. Hegner, Marcos Rellán‐Piñeiro, 2020, The Journal of chemical physics.

Shape control in concave metal nanoparticles by etching.

N. López, I. Remediakis, Marcos Rellán‐Piñeiro, 2017, Nanoscale.

A mechanism for the selective epimerization of the glucose mannose pair by Mo-based compounds: towards catalyst optimization

N. López, Marcos Rellán‐Piñeiro, M. Garcia-Ratés, 2017 .

Enhanced Performance of Zirconium-Doped Ceria Catalysts for the Methoxycarbonylation of Anilines.

B. Puértolas, N. López, A. Vidal‐Ferran, 2020, Chemistry.

One Oxygen Vacancy, Two Charge States: Characterization of Reduced α-MoO3(010) through Theoretical Methods.

N. López, Marcos Rellán‐Piñeiro, 2018, The journal of physical chemistry letters.

Activity differences of rutile and anatase TiO2 polymorphs in catalytic HBr oxidation

N. López, V. Paunović, Marcos Rellán‐Piñeiro, 2020 .

A Coupled Density Functional Theory–Microkinetic Modeling for the Hydrodeoxygenation of Glycerol to Propylene on MoO3

N. López, Marcos Rellán‐Piñeiro, 2018, ACS Sustainable Chemistry & Engineering.

Analysis of the performance of DFT-D, M05-2X and M06-2X functionals for studying π⋯π interactions

E. Cabaleiro-Lago, J. Rodríguez-Otero, D. Josa, 2013 .

Mechanistic Insights into the Ceria-Catalyzed Synthesis of Carbamates as Polyurethane Precursors

B. Puértolas, N. López, Amol P. Amrute, 2019, ACS Catalysis.

The Active Molybdenum Oxide Phase in the Methanol Oxidation to Formaldehyde (Formox Process): A DFT Study.

N. López, Marcos Rellán‐Piñeiro, 2015, ChemSusChem.