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José Daniel Gouveia

Observed names: Gouveia, José D., J D Gouveia, J. D. Gouveia, J.D. Gouveia, Jose Gouveia, José D. Gouveia, José D. Gouveia, José D Gouveia, José D. Gouveia
ORCID: 0000-0002-5099-7772
Observed ORCID: 0000-0002-5099-7772
OpenAlex ID: A5015116371
MXenes as promising catalysts for water dissociation
2019 · José D. Gouveia, Ángel Morales-García, et al. · Applied Catalysis B: Environmental · 163
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Facile Heterogeneously Catalyzed Nitrogen Fixation by MXenes
2020 · José D. Gouveia, Ángel Morales-García, et al. · ACS Catalysis · 118
Carbon Capture and Usage by MXenes
2021 · Raul Morales-Salvador, José D. Gouveia, et al. · ACS Catalysis · 88
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MXenes atomic layer stacking phase transitions and their chemical activity consequences
2020 · José D. Gouveia, Francesc Viñes, et al. · Physical Review Materials · 87
First-principles and machine-learning approaches for interpreting and predicting the properties of MXenes
2025 · José D. Gouveia, Tiago L. P. Galvão, et al. · npj 2D Materials and Applications · 73
First-Principles Calculations on the Adsorption Behavior of Amino Acids on a Titanium Carbide MXene
2020 · José D. Gouveia, Gerard Novell-Leruth, et al. · ACS Applied Bio Materials · 67
The Ti2CO2 MXene as a nucleobase 2D sensor: A first-principles study
2021 · José D. Gouveia, Gerard Novell-Leruth, et al. · Applied Surface Science · 64
Origami rules for the construction of localized eigenstates of the Hubbard model in decorated lattices
2015 · R. G. Dias, J. D. Gouveia · Scientific Reports · 57
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Structural and energetic properties of vacancy defects in MXene surfaces
2022 · José D. Gouveia, José R. B. Gomes · Physical Review Materials · 54
Effect of the surface termination on the adsorption of flue gas by the titanium carbide MXene
2023 · J.D. Gouveia, J.R.B. Gomes · Materials Today Chemistry · 35
Can we rely on hybrid-DFT energies of solid-state problems with local-DFT geometries?
2019 · J D Gouveia, J Coutinho · Electronic Structure · 30
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MXenes à la Carte : Tailoring the Epitaxial Growth Alternating Nitrogen and Transition Metal Layers
2022 · José D. Gouveia, Ángel Morales-García, et al. · ACS Nano · 28
The determining role of T species in the catalytic potential of MXenes: Water adsorption and dissociation on Mo2CT
2022 · José D. Gouveia, José R.B. Gomes · Catalysis Today · 27
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Multiscale Computational Approaches toward the Understanding of Materials
2022 · Marta Bordonhos, Tiago L. P. Galvão, et al. · Advanced Theory and Simulations · 24
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Sticky-MARTINI as a reactive coarse-grained model for molecular dynamics simulations of silica polymerization
2022 · André P. Carvalho, Sérgio M. Santos, et al. · npj Computational Materials · 22
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Structural and electronic properties of the titanium carbide MXene with variable sublattice oxygen composition
2024 · José D. Gouveia, José R.B. Gomes · Surfaces and Interfaces · 21
Surface-Enhanced Raman Scattering due to a Synergistic Effect on ZnS and Graphene Oxide
2020 · Joana L. Lopes, Sara Fateixa, et al. · The Journal of Physical Chemistry C · 21
Predicting Adsorption Energies on MXene Surfaces Using Machine Learning to Enhance Catalyst Design for the Water–Gas Shift Reaction
2025 · Kais Iben Nassar, Tiago L. P. Galvão, et al. · The Journal of Physical Chemistry C · 20
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Magnetic phase diagram of the Hubbard model in the Lieb lattice
2015 · J.D. Gouveia, R.G. Dias · Journal of Magnetism and Magnetic Materials · 20
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M-center in 4H-SiC: Isothermal DLTS and first principles modeling studies
2021 · I. Capan, T. Brodar, et al. · Journal of Applied Physics · 19
M center in 4 H -SiC is a carbon self-interstitial
2021 · J. Coutinho, J. D. Gouveia, et al. · Physical review. B./Physical review. B · 18
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Catalytic reactions for H2 production on multimetallic surfaces: a review
2021 · Rui V Afonso, José D Gouveia, et al. · Journal of Physics Energy · 16
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Transition metal atom adsorption on the titanium carbide MXene: Trends across the periodic table for the bare and O-terminated surfaces
2022 · Henrique Rocha, José D. Gouveia, et al. · Physical Review Materials · 15
Spin and charge density waves in the Lieb lattice
2016 · J.D. Gouveia, R.G. Dias · Journal of Magnetism and Magnetic Materials · 15
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MXene-supported transition metal single-atom catalysts for nitrogen dissociation
2023 · José D. Gouveia, Henrique Rocha, et al. · Molecular Catalysis · 14
Works count: 65
Citation count: 1,224
H-index: 19
I10-index: 28
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