Articles with public access mandates - José R. B. GomesLearn more
Not available anywhere: 32
Density functional theory study of the water dissociation on platinum surfaces: general trends
JLC Fajin, MN DS Cordeiro, JRB Gomes
The Journal of Physical Chemistry A 118 (31), 5832-5840, 2014
Mandates: Fundação para a Ciência e a Tecnologia, Portugal
Structure of Chemisorbed CO2 Species in Amine-Functionalized Mesoporous Silicas Studied by Solid-State NMR and Computer Modeling
L Mafra, T Cendak, S Schneider, PV Wiper, J Pires, JRB Gomes, ML Pinto
Journal of the American Chemical Society 139 (1), 389-408, 2017
Mandates: Fundação para a Ciência e a Tecnologia, Portugal, European Commission
Amine functionalized porous silica for CO2/CH4 separation by adsorption: Which amine and why
L Mafra, T Čendak, S Schneider, PV Wiper, J Pires, JRB Gomes, ML Pinto
Chemical Engineering Journal 336, 612-621, 2018
Mandates: Fundação para a Ciência e a Tecnologia, Portugal, European Commission
Molecular dynamics simulation of diffusion coefficients and structural properties of ketones in supercritical CO2 at infinite dilution
RV Vaz, JRB Gomes, CM Silva
The Journal of Supercritical Fluids 107, 630-638, 2016
Mandates: Fundação para a Ciência e a Tecnologia, Portugal, European Commission
Control of crystallite and particle size in the synthesis of layered double hydroxides: Macromolecular insights and a complementary modeling tool
TLP Galvão, CS Neves, APF Caetano, F Maia, D Mata, E Malheiro, ...
Journal of Colloid and Interface Science 468, 86-94, 2016
Mandates: Fundação para a Ciência e a Tecnologia, Portugal, European Commission
Enhancement of ethane selectivity in ethane–ethylene mixtures by perfluoro groups in Zr-based metal-organic frameworks
J Pires, J Fernandes, K Dedecker, JRB Gomes, G Perez-Sanchez, ...
ACS applied materials & interfaces 11 (30), 27410-27421, 2019
Mandates: Fundação para a Ciência e a Tecnologia, Portugal, European Commission …
Corrosion inhibition of copper in aqueous chloride solution by 1 H-1, 2, 3-triazole and 1, 2, 4-triazole and their combinations: electrochemical, Raman and theoretical studies
SU Ofoegbu, TLP Galvão, JRB Gomes, J Tedim, HIS Nogueira, ...
Physical Chemistry Chemical Physics 19 (8), 6113-6129, 2017
Mandates: Fundação para a Ciência e a Tecnologia, Portugal, European Commission
First-principles calculations on the adsorption behavior of amino acids on a titanium carbide MXene
JD Gouveia, G Novell-Leruth, PMLS Reis, F Viñes, F Illas, JRB Gomes
ACS Applied Bio Materials 3 (9), 5913-5921, 2020
Mandates: Fundação para a Ciência e a Tecnologia, Portugal, European Commission …
Generalized Brønsted–Evans–Polanyi relationships and descriptors for O–H bond cleavage of organic molecules on transition metal surfaces
JLC Fajín, MNDS Cordeiro, F Illas, JRB Gomes
Journal of catalysis 313, 24-33, 2014
Mandates: Fundação para a Ciência e a Tecnologia, Portugal, Government of Spain
Simple, mono and bifunctional periodic mesoporous organosilicas for removal of priority hazardous substances from water: The case of mercury (II)
MAO Lourenço, P Figueira, E Pereira, JRB Gomes, CB Lopes, P Ferreira
Chemical Engineering Journal 322, 263-274, 2017
Mandates: Fundação para a Ciência e a Tecnologia, Portugal, European Commission
The Ti2CO2 MXene as a nucleobase 2D sensor: A first-principles study
JD Gouveia, G Novell-Leruth, F Viñes, F Illas, JRB Gomes
Applied Surface Science 544, 148946, 2021
Mandates: Fundação para a Ciência e a Tecnologia, Portugal, European Commission …
Multifunctionality in an ion-exchanged porous metal–organic framework
SMF Vilela, JAR Navarro, P Barbosa, RF Mendes, G Perez-Sanchez, ...
Journal of the American Chemical Society 143 (3), 1365-1376, 2021
Mandates: Fundação para a Ciência e a Tecnologia, Portugal, European Commission …
Concepts, models, and methods in computational heterogeneous catalysis illustrated through CO2 conversion
Á Morales‐García, F Viñes, JRB Gomes, F Illas
Wiley Interdisciplinary Reviews: Computational Molecular Science 11 (4), e1530, 2021
Mandates: Fundação para a Ciência e a Tecnologia, Portugal, European Commission …
Understanding polymorphic control of pharmaceuticals using imidazolium-based ionic liquid mixtures as crystallization directing agents
ICB Martins, JRB Gomes, MT Duarte, L Mafra
Crystal Growth & Design 17 (2), 428-432, 2017
Mandates: Fundação para a Ciência e a Tecnologia, Portugal
Pyrolyzed chitosan-based materials for CO2/CH4 separation
MAO Lourenço, C Nunes, JRB Gomes, J Pires, ML Pinto, P Ferreira
Chemical Engineering Journal 362, 364-374, 2019
Mandates: Fundação para a Ciência e a Tecnologia, Portugal
Structural and energetic properties of vacancy defects in MXene surfaces
JD Gouveia, JRB Gomes
Physical Review Materials 6 (2), 024004, 2022
Mandates: Fundação para a Ciência e a Tecnologia, Portugal
Structural, energetic and reactivity properties of phenoxazine and phenothiazine
VLS Freitas, JRB Gomes, MDMCR da Silva
The Journal of Chemical Thermodynamics 73, 110-120, 2014
Mandates: Fundação para a Ciência e a Tecnologia, Portugal
Periodic mesoporous organosilica with low thiol density–a safer material to trap Hg (II) from water
P Figueira, MAO Lourenço, E Pereira, JRB Gomes, P Ferreira, CB Lopes
Journal of Environmental Chemical Engineering 5 (5), 5043-5053, 2017
Mandates: Fundação para a Ciência e a Tecnologia, Portugal, European Commission
Water dissociation on multimetallic catalysts
JLC Fajin, MNDS Cordeiro, JRB Gomes
Applied Catalysis B: Environmental 218, 199-207, 2017
Mandates: Fundação para a Ciência e a Tecnologia, Portugal, European Commission
Surface-enhanced Raman scattering due to a synergistic effect on ZnS and graphene oxide
JL Lopes, S Fateixa, AC Estrada, JD Gouveia, JRB Gomes, T Trindade
The Journal of Physical Chemistry C 124 (23), 12742-12751, 2020
Mandates: Fundação para a Ciência e a Tecnologia, Portugal, European Commission
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