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José D. Gouveia (JDG, https://orcid.org/0000-0002-5099-7772) is a researcher at CICECO-Aveiro Institute of Materials at the University of Aveiro. As a student, he was awarded several prizes, including that of best student among all areas of science and engineering. He finished his PhD in Physics in 2017 at the University of Aveiro, where he focused on the transition between conducting and insulating systems, by studying the Hubbard model on two-dimensional decorated lattices. Before settling at CICECO, JDG was a post-doc researcher at the NATO project e-SiCure (https://www2.irb.hr/korisnici/capan/esicure2/index.htm), a consortium gathering partners in Slovenia, Croatia, Japan and Portugal, where he used ab initio DFT-based computational methods to study defects in SiC which may lead to limitations in detection efficiency. In CICECO, JDG started a new research line devoted to the computational analysis of the potential of MXenes for sensing and catalytic applications and of the enhancement of their catalytic potential by changes in their atomic layer stacking, and strengthened the scientific collaboration with several international groups, such as those of Francesc Illas at the University of Barcelona, Spain, of Kai Exner at the University of Essen, Germany, and Anna Zielinska-Jurek at the Gdansk University of Technology, Poland. He submitted successful applications to the Europa-HPC3 programme (awarded 60 kCPU.hours), to the Spanish Supercomputing Network (awarded 4 MCPU.hours) and to the FCT Calls for Advanced Computing Projects (2.6 MCPU.hours). He has published 30 papers in top journals (e.g. ACS Catal., ACS Appl. Bio Mater., Appl. Catal. B: Environ.; Appl. Surf. Sci.) with a total of over 450 citations so far. His work was also disseminated in tens of national and international scientific conferences. He is currently supervising an MSc student (Joana Figueiredo) and a Post-doc researcher (Kais Nassar), has supervised 3 MSc students and 3 BSc students, and helped supervise an MSc student (Raul Morales-Salvador) at the University of Barcelona, Spain, and a PhD student (Joana Lopes) at CICECO, Portugal. He contributes on a regular basis to motivating the career of young scientists as a scientific monitor at the Summer Academy of the Physics Department at the University of Aveiro.
Identification

Personal identification

Full name
JOSÉ DANIEL LAGO DA SILVA NEVES GOUVEIA

Citation names

  • Gouveia, Jose
  • J. D. Gouveia

Author identifiers

Ciência ID
BF1D-D59F-0B99

Languages

Language Speaking Reading Writing Listening Peer-review
Portuguese Proficiency (C2) Proficiency (C2) Proficiency (C2) Proficiency (C2)
English Proficiency (C2) Proficiency (C2) Proficiency (C2) Proficiency (C2)
Education
Degree Classification
2017/03/24
Concluded
Physics Doctoral Programme MAP-Fis (Doutoramento)
Universidade de Aveiro, Portugal
"Magnetic properties of quantum electronic systems with non-trivial geometries" (THESIS/DISSERTATION)
Aprovado com distinção e louvor, lit. approved with highest distinction & praise
2010
Concluded
Physics (Mestrado)
Universidade de Aveiro, Portugal
"The helicoidal Hubbard model" (THESIS/DISSERTATION)
17
2008
Concluded
Physics (Licenciatura)
Universidade de Aveiro, Portugal
"The Helicoidal Hubbard Model" (THESIS/DISSERTATION)
18
Affiliation

Science

Category
Host institution
Employer
2023/08/16 - 2029/08/15 Contracted Researcher (Research) Fundação para a Ciência e a Tecnologia, Portugal
Universidade de Aveiro CICECO, Portugal
2022/02/15 - 2023/08/14 Contracted Researcher (Research) Universidade de Aveiro CICECO, Portugal
Universidade de Aveiro CICECO, Portugal
2019/01/01 - 2021/11/30 Contracted Researcher (Research) Universidade de Aveiro CICECO, Portugal
Universidade de Aveiro CICECO, Portugal
2018/05/01 - 2018/12/31 Postdoc (Research) Universidade de Aveiro Departamento de Física, Portugal
Universidade de Aveiro Departamento de Física, Portugal
2016/12/16 - 2017/12/15 Researcher (Research) Fundação para a Ciência e a Tecnologia, Portugal
Universidade de Aveiro Departamento de Física, Portugal
2016/03/16 - 2016/09/15 Researcher (Research) Fundação para a Ciência e a Tecnologia, Portugal
Universidade de Aveiro Departamento de Física, Portugal
2015/09/01 - 2015/12/31 Researcher (Research) Fundação para a Ciência e a Tecnologia, Portugal
Universidade de Aveiro Departamento de Física, Portugal
2010/03/01 - 2010/10/31 Researcher (Research) Fundação para a Ciência e a Tecnologia, Portugal
Universidade de Aveiro Departamento de Física, Portugal

Teaching in Higher Education

Category
Host institution
Employer
2017/01/01 - 2017/06/30 Invited Assistant Professor (University Teacher) Universidade de Aveiro Departamento de Física, Portugal
2015/09/01 - 2016/01/31 Invited Assistant Professor (University Teacher) Universidade de Aveiro Departamento de Física, Portugal
2012/01/01 - 2012/06/30 Invited Assistant Professor (University Teacher) Universidade de Aveiro Departamento de Física, Portugal

Others

Category
Host institution
Employer
2011/04/01 - 2015/03/31 PhD Scholarship SFRH/BD/73057/2010 Fundação para a Ciência e a Tecnologia, Portugal
Projects

Grant

Designation Funders
2023/06/01 - 2024/05/31 MXene-based transition metal single atom catalysts for nitrogen dissociation
2022.15802.CPCA.A2
Principal investigator
Fundação para a Ciência e a Tecnologia, Portugal
Fundação para a Ciência e a Tecnologia
2022/07/01 - 2023/06/30 Structural, energetic and catalytic properties of vacancy defects in MXene surfaces
2021.09799.CPCA
Co-Principal Investigator (Co-PI)
Fundação para a Ciência e a Tecnologia, Portugal
Fundação para a Ciência e a Tecnologia
2022/01/01 - 2023/06/30 Stacking and Partial Oxidation Effects on the Reverse Water Gas Shift Reaction by MXenes
QHS-2022-3-0017
Researcher
Centro Nacional de Supercomputación, Spain
Centro Nacional de Supercomputación
Ongoing

Contract

Designation Funders
2019/01/01 - Current COST Action CA18234 - Computational materials sciences for efficient water splitting with nanocrystals from abundant elements
Researcher
Ongoing
2021/01/01 - 2025/12/31 CICECO ¿ Aveiro Institute of Materials
LA/P/0006/2020
Universidade de Aveiro, Portugal

Universidade de Aveiro CICECO, Portugal
Fundação para a Ciência e a Tecnologia
Ongoing
2023/01/01 - 2023/12/31 MXene catalysts for the water gas shift reaction
2022.02949.PTDC
Co-Principal Investigator (Co-PI)
Universidade de Aveiro CICECO, Portugal
Fundação para a Ciência e a Tecnologia
Ongoing
2022/06/01 - 2023/05/31 ForTheShift: MXenes as catalysts for the water gas shift reaction
2021.09799.CPCA
Co-Principal Investigator (Co-PI)
Universidade de Aveiro CICECO, Portugal
Fundação para a Ciência e a Tecnologia
Ongoing
2021/07/01 - 2021/12/31 Epitaxial Growth of Nitrogen and Metal Layers on MXene Seed Structures
QHS-2021-2-0009
Researcher
Centro Nacional de Supercomputación, Spain
Centro Nacional de Supercomputación
Concluded
2021/01/01 - 2021/06/30 Epitaxial growth of multimetallic MXenes via nitrogen dissociation
CPCA/A2/6817/2020
Principal investigator
Universidade de Aveiro CICECO, Portugal

Universidade de Coimbra Faculdade de Ciencias e Tecnologia, Portugal
Ongoing
2021/01/01 - 2021/06/30 Epitaxial Growth of Nitrogen and Metal Layers on MXene Seed Structures
QHS-2021-3-0008
Researcher
Centro Nacional de Supercomputación, Spain
Centro Nacional de Supercomputación
Concluded
2019/01/01 - 2021/06/30 SILVIA - Modeling the synthesis of silica materials via multiscale computer simulations
Researcher
Universidade de Aveiro CICECO, Portugal
Ongoing
2019/07/01 - 2021/05/30 Modeling the synthesis of silica materials with a novel reactive coarse-grained model
QS-2019-2-0034
Researcher
Ongoing
2019/07/01 - 2019/12/31 Dissociation mechanism of water on two-dimensional transition metal carbides (MXenes)
QS-2019-2-0019
Researcher
Concluded
2019/01/01 - 2019/12/31 Institute of Nanostructures, Nanomodelling and Nanofabrication
UID/CTM/50025/2019
Universidade do Minho, Portugal

UNINOVA Instituto de Desenvolvimento de Novas Tecnologias, Portugal

Universidade de Aveiro, Portugal

Universidade NOVA de Lisboa Faculdade de Ciências e Tecnologia, Portugal

Associação para a Inovação e Desenvolvimento da FCT, Portugal

Universidade NOVA de Lisboa, Portugal

Instituto de Nanoestruturas Nanomodelação e Nanofabricação, Portugal
Fundação para a Ciência e a Tecnologia
Concluded
2018/05/01 - 2018/12/31 E-SICURE - Engineering silicon carbide for enhanced borders and ports security
Post-doc Fellow
Concluded
Outputs

Publications

Conference poster
  1. Figueiredo, Joana S.; Fateixa, Sara; Lopes, Joana Lúcia Marto dos Santos; Estrada, Ana C.; J. D. Gouveia; J. R. Gomes; Trindade, Tito. Corresponding author: Figueiredo, Joana S.. "SERS studies on zinc chalcogenides supported on graphene oxide". Paper presented in 15ENQF-15º Encontro Nacional Química Física, ONLINE (4th-5th of April, 2023), 2023.
Journal article
  1. Hasanov, Bashir E.; Casanova-Chafer, Juan; Deokar, Geetanjali; Gouveia, José D.; Nematulloev, Saidkhodzha; Gomes, José R.B.; Llobet, Eduard; Costa, Pedro M.F.J.. "Amplified sensing of nitrogen dioxide with a phosphate-doped reduced graphene oxide powder". Carbon 226 (2024): 119207. http://dx.doi.org/10.1016/j.carbon.2024.119207.
    Published • 10.1016/j.carbon.2024.119207
  2. Gouveia, José D.; Gomes, José R.B.. "Structural and electronic properties of the titanium carbide MXene with variable sublattice oxygen composition". Surfaces and Interfaces 46 (2024): 103920. http://dx.doi.org/10.1016/j.surfin.2024.103920.
    10.1016/j.surfin.2024.103920
  3. J. D. Gouveia; José R. B. Gomes. "Cu-doped polymeric carbon nitrides: structural and electronic properties and sensitivity to flue gas". Surfaces and Interfaces (2024): https://ssrn.com/abstract=4695388.
    Open access • Accepted
  4. Gouveia, José D.; Rocha, Henrique; Gomes, José R.B.. "MXene-supported transition metal single-atom catalysts for nitrogen dissociation". Molecular Catalysis 547 (2023): 113373. http://dx.doi.org/10.1016/j.mcat.2023.113373.
    10.1016/j.mcat.2023.113373
  5. Gouveia, J.D.; Gomes, J.R.B.. "Effect of the surface termination on the adsorption of flue gas by the titanium carbide MXene". Materials Today Chemistry 29 (2023): 101441. http://dx.doi.org/10.1016/j.mtchem.2023.101441.
    10.1016/j.mtchem.2023.101441
  6. Bordonhos, Marta; Galvão, Tiago L. P.; Gomes, José R. B.; J. D. Gouveia; Jorge, Miguel; Lourenço, Mirtha A. O.; Pereira, José M.; et al. "Multiscale Computational Approaches toward the Understanding of Materials". Advanced Theory and Simulations (2022): 2200628. http://dx.doi.org/10.1002/adts.202200628.
    10.1002/adts.202200628
  7. Rocha, Henrique; J. D. Gouveia; Gomes, José R. B.. "Transition metal atom adsorption on the titanium carbide MXene: Trends across the periodic table for the bare and O-terminated surfaces". Physical Review Materials 6 10 (2022): http://dx.doi.org/10.1103/physrevmaterials.6.105801.
    10.1103/physrevmaterials.6.105801
  8. Dudziak, Szymon; Kowalkinska, Marta; Karczewski, Jakub; Pisarek, Marcin; J. D. Gouveia; Gomes, José R. B.; Zielinska-Jurek, Anna. "Surface and Trapping Energies as Predictors for the Photocatalytic Degradation of Aromatic Organic Pollutants". The Journal of Physical Chemistry C 126 35 (2022): 14859-14877. http://dx.doi.org/10.1021/acs.jpcc.2c02775.
    10.1021/acs.jpcc.2c02775
  9. J. D. Gouveia; Morales-García, Ángel; Viñes, Francesc; Gomes, José R. B.; Illas, Francesc. "MXenes à la Carte: Tailoring the Epitaxial Growth Alternating Nitrogen and Transition Metal Layers". ACS Nano 16 8 (2022): 12541-12552. http://dx.doi.org/10.1021/acsnano.2c04029.
    10.1021/acsnano.2c04029
  10. J. D. Gouveia; Gomes, José R.B.. "The determining role of T species in the catalytic potential of MXenes: Water adsorption and dissociation on Mo2CT". Catalysis Today (2022): http://dx.doi.org/10.1016/j.cattod.2022.07.016.
    10.1016/j.cattod.2022.07.016
  11. Carvalho, André P.; Santos, Sérgio M.; Pérez-Sánchez, Germán; Gouveia, José D.; Gomes, José R. B.; Jorge, Miguel. "Sticky-MARTINI as a reactive coarse-grained model for molecular dynamics simulations of silica polymerization". npj Computational Materials 8 1 (2022): http://dx.doi.org/10.1038/s41524-022-00722-w.
    10.1038/s41524-022-00722-w
  12. Gouveia, José D.; Gomes, José R. B.. "Structural and energetic properties of vacancy defects in MXene surfaces". Physical Review Materials 6 2 (2022): http://dx.doi.org/10.1103/physrevmaterials.6.024004.
    10.1103/physrevmaterials.6.024004
  13. Capan, I.; Brodar, T.; Bernat, R.; Pastuovic, Ž.; Makino, T.; Ohshima, T.; Gouveia, J. D.; Coutinho, J.. "M-center in 4H-SiC: Isothermal DLTS and first principles modeling studies". Journal of Applied Physics 130 12 (2021): 125703. http://dx.doi.org/10.1063/5.0064958.
    10.1063/5.0064958
  14. Morales-Salvador, Raul; Gouveia, José D.; Morales-García, Ángel; Viñes, Francesc; Gomes, José R. B.; Illas, Francesc. "Carbon Capture and Usage by MXenes". ACS Catalysis (2021): 11248-11255. http://dx.doi.org/10.1021/acscatal.1c02663.
    10.1021/acscatal.1c02663
  15. Afonso, Rui V; Gouveia, José D; Gomes, José R B. "Catalytic reactions for H2 production on multimetallic surfaces: a review". Journal of Physics: Energy 3 3 (2021): 032016. http://dx.doi.org/10.1088/2515-7655/ac0d9f.
    10.1088/2515-7655/ac0d9f
  16. Coutinho, J.; Gouveia, J. D.; Makino, T.; Ohshima, T.; Pastuovic, Ž.; Bakrac, L.; Brodar, T.; Capan, I.. "M center in 4 H -SiC is a carbon self-interstitial". Physical Review B 103 18 (2021): http://dx.doi.org/10.1103/physrevb.103.l180102.
    10.1103/physrevb.103.l180102
  17. Gouveia, José D.; Novell-Leruth, Gerard; Viñes, Francesc; Illas, Francesc; Gomes, José R.B.. "The Ti2CO2 MXene as a nucleobase 2D sensor: A first-principles study". Applied Surface Science 544 (2021): 148946. http://dx.doi.org/10.1016/j.apsusc.2021.148946.
    10.1016/j.apsusc.2021.148946
  18. Pino, J. P.; Alves, P.; Gouveia, J. D.; Marques, A. M.; Dias, R. G.. "Topologically protected states in a spider web lattice". Physical Review Research 2 4 (2020): http://dx.doi.org/10.1103/physrevresearch.2.043337.
    10.1103/physrevresearch.2.043337
  19. Gouveia, José D.; Novell-Leruth, Gerard; Reis, Pedro M. L. S.; Viñes, Francesc; Illas, Francesc; Gomes, José R. B.. "First-Principles Calculations on the Adsorption Behavior of Amino Acids on a Titanium Carbide MXene". ACS Applied Bio Materials 3 9 (2020): 5913-5921. http://dx.doi.org/10.1021/acsabm.0c00621.
    10.1021/acsabm.0c00621
  20. Gouveia, José D.; Pérez-Sánchez, Germán; Santos, Sérgio M.; Carvalho, André P.; Gomes, José R.B.; Jorge, Miguel. "Mesoscale model of the synthesis of periodic mesoporous benzene-silica". Journal of Molecular Liquids (2020): 113861. http://dx.doi.org/10.1016/j.molliq.2020.113861.
    10.1016/j.molliq.2020.113861
  21. Lopes, Joana L.; Fateixa, Sara; Estrada, Ana C.; Gouveia, José D.; Gomes, José R. B.; Trindade, Tito. "Surface-Enhanced Raman Scattering due to a Synergistic Effect on ZnS and Graphene Oxide". The Journal of Physical Chemistry C 124 23 (2020): 12742-12751. http://dx.doi.org/10.1021/acs.jpcc.0c02135.
    10.1021/acs.jpcc.0c02135
  22. Gouveia, José D.; Viñes, Francesc; Illas, Francesc; Gomes, José R. B.. "MXenes atomic layer stacking phase transitions and their chemical activity consequences". Physical Review Materials 4 5 (2020): http://dx.doi.org/10.1103/physrevmaterials.4.054003.
    10.1103/physrevmaterials.4.054003
  23. Gouveia, José D.; Morales-García, Ángel; Viñes, Francesc; Gomes, José R. B.; Illas, Francesc. "Facile Heterogeneously Catalyzed Nitrogen Fixation by MXenes". ACS Catalysis (2020): 5049-5056. http://dx.doi.org/10.1021/acscatal.0c00935.
    10.1021/acscatal.0c00935
  24. Gouveia, José D.; Morales-García, Ángel; Viñes, Francesc; Illas, Francesc; Gomes, José R.B.. "MXenes as promising catalysts for water dissociation". Applied Catalysis B: Environmental 260 (2020): 118191. http://dx.doi.org/10.1016/j.apcatb.2019.118191.
    10.1016/j.apcatb.2019.118191
  25. Gouveia, J D; Coutinho, J. "Can we rely on hybrid-DFT energies of solid-state problems with local-DFT geometries?". Electronic Structure 1 1 (2019): 015008. http://dx.doi.org/10.1088/2516-1075/aafc4b.
    10.1088/2516-1075/aafc4b
  26. Gouveia, J.D.. "Localized states in bipartite fcc lattices". Journal of Magnetism and Magnetic Materials 468 (2018): 44-49. http://dx.doi.org/10.1016/j.jmmm.2018.07.079.
    10.1016/j.jmmm.2018.07.079
  27. Gouveia, J. D.; Maceira, I. A.; Dias, R. G.. "Evolution of localized states in Lieb lattices under time-dependent magnetic fields". Physical Review B 94 19 (2016): http://dx.doi.org/10.1103/physrevb.94.195132.
    10.1103/physrevb.94.195132
  28. Gouveia, J.D.; Dias, R.G.. "Spin and charge density waves in the Lieb lattice". Journal of Magnetism and Magnetic Materials 405 (2016): 292-303. http://dx.doi.org/10.1016/j.jmmm.2015.12.096.
    10.1016/j.jmmm.2015.12.096
  29. Dias, R. G.; Gouveia, J. D.. "Origami rules for the construction of localized eigenstates of the Hubbard model in decorated lattices". Scientific Reports 5 1 (2015): http://dx.doi.org/10.1038/srep16852.
    10.1038/srep16852
  30. Gouveia, J.D.; Dias, R.G.. "Magnetic phase diagram of the Hubbard model in the Lieb lattice". Journal of Magnetism and Magnetic Materials 382 (2015): 312-317. http://dx.doi.org/10.1016/j.jmmm.2015.02.005.
    10.1016/j.jmmm.2015.02.005
  31. Gouveia, J.D.; Dias, R.G.. "Spiral ferrimagnetic phases in the two-dimensional Hubbard model". Solid State Communications 185 (2014): 21-24. http://dx.doi.org/10.1016/j.ssc.2014.01.004.
    10.1016/j.ssc.2014.01.004
Activities

Oral presentation

Presentation title Event name
Host (Event location)
2023/09/27 Effect of surface functionalization on the adsorption of small molecules by the titanium carbide MXene SECSMol: Southern European Conference on the Science of Molecules
Universita degli Studi di Perugia (Perugia, Italy)
2023/08/03 The Role of Surface Terminations of MXenes in Catalysis and Adsorption: A Computational Analysis Materials Today Conference 2023
Singapore Expo (Singapore)
2023/05/23 Water dissociation on MXenes Theoretical Inorganic Chemistry Group Meeting
University of Duisburg-Essen (Essen, Germany)
2023/02/06 Applications of MXenes in heterogeneous catalysis: A computational perspective Ab-initio Simulation Package (VASP) Ecosystem
University of Évora (Évora, Portugal)
2022/09/07 Sticky MARTINI: a Reactive Coarse-Grained Model for Self-Assembly in Materials Synthesis Thermodynamics Conference
University of Bath (Bath, United Kingdom)
2021/09/21 The potential of abundant metals for catalyzing the water dissociation reaction Virtual workshop “Catalysis for Water Splitting”
COST Action CA18234 (Web conference)
2021/03/29 Coarse-grained model of the synthesis of periodic mesoporous benzene-silica 14th National Meeting of Physical Chemistry
Portuguese Chemistry Society (Web conference)
2021/01/27 The Potential of MXenes for Catalysis: A Computational Point of View Catalysts Webinar: Recent Advances in Computational Catalysis II
MDPI open access publishing (Web conference)
2020/12/16 Surface chemical-modification of graphene materials for optical sensors Physical Chemistry Talks on Stream
University of Coimbra (Web conference)
2020/11/25 Feasibility of MXenes to Catalyze the Dissociation of Nitrogen Catalysis Talks
European Chemical Society (Web conference)
2020/02/12 Water dissociation on two dimensional transition metal carbides or nitrides a.k.a. MXenes International Conferences on Computational Materials Science for Nanoscale Modeling
University of Naples Federico II (Naples, Italy)
2019/07/25 A computational study on the water splitting reaction by MXenes XXVI Meeting of the Portuguese Chemistry Society
Faculty of Sciences of the University of Porto (Porto, Portugal)
2019/07/09 Coarse-grained molecular dynamics model of periodic mesoporous benzene-silica Computer Modeling and Simulation Day
Universidade de Aveiro (Aveiro, Portugal)
2018/09/06 Carbon vacancies and interstitials in 3C- and 4H-SiC: theoretical milestones and challenges 12th European Conference on Silicon Carbide and Related Materials
University of Warwick (Birmingham , United Kingdom)
2015/01/06 Spin density waves and charge modulation in the Lieb lattice II Mini-Workshop on Theoretical Condensed Matter Physics
Instituto Superior Técnico (Lisboa, Portugal)
2014/10/06 Spiral ferrimagnetic phases in the 2D Hubbard model Workshop on correlations, criticality, and coherence in quantum systems
Universidade de Évora (Évora, Portugal)

Supervision

Thesis Title
Role
Degree Subject (Type)
Institution / Organization
2023/05/02 - 2024/10/31 MXene catalysts for the water gas shift reaction
Co-supervisor
Universidade de Aveiro CICECO, Portugal
2023/11/16 - 2024/07/31 Developing a new spectroscopic tool to probe semiconductors on graphene oxide
Co-supervisor
Chemistry (Master)
Universidade de Aveiro CICECO, Portugal
2024/02/01 - 2024/07/30 Computational study of the adsorption of amino acids on polymeric carbon nitride
Supervisor
Biochemistry (Degree)
Universidade de Aveiro CICECO, Portugal
2021/10/01 - 2022/07/20 The role of single transition-metal atoms deposited on the Ti2C MXene in the adsorption and dissociation of nitrogen
Supervisor
Chemistry (Master)
Universidade de Aveiro CICECO, Portugal
2019/01/07 - 2019/07/22 CO2 Dissociation as Catalysed by MXenes
Co-supervisor
Centro Nacional de Supercomputación, Spain
2017/09/15 - 2018/07/25 Interacting electrons in a quantum spider web
Supervisor
Engenharia Física (Degree)
Universidade de Aveiro Departamento de Física, Portugal
2015/09/01 - 2016/06/30 Time evolution of localized states of the Lieb lattice
Supervisor
Physics (Master)
Universidade de Aveiro, Portugal

Event organisation

Event name
Type of event (Role)
Institution / Organization
2023/03/01 - 2033/05/19 Introduction to molecular simulation: Molecular docking, molecular mechanics and quantum mechanics URL: https://sites.google.com/view/short-course-at-univ-aveiro/index-html (2023/05/16 - 2033/05/19)
Workshop (Member of the Organising Committee)
2022/01/11 - 2022/07/12 NANOWS 2022 - bringing together researchers pioneering the development and/or application of computer simulations approaches to the understanding of the photocatalytic water splitting with nanocrystals from abundant elements. URL: https://sweet.ua.pt/jrgomes/NANOWS-2022/ (2022/07/11 - 2022/07/12)
Conference (Co-organisor)
Universidade de Aveiro, Portugal
2021/01/24 - 2021/03/24 Computer Modelling and Simulation Day 2021 (2021/03/24 - 2021/03/24)
Conference (Co-organisor)
Universidade de Aveiro CICECO, Portugal

Event participation

Activity description
Type of event
Event name
Institution / Organization
2023/07/24 - 2033/07/26 Conference poster: A data-driven approach to unveil the reactivity of MXene-based catalysts for the water gas shift reaction
Conference
Sociedade Portuguesa de Química, Portugal

Jury of academic degree

Topic
Role
Candidate name (Type of degree)
Institution / Organization
2022/02/21 Detection of cancer-related biomarkers
(Thesis) Arguer
Fábio Alexandre Gomes Ramalho (Master)
Universidade de Aveiro, Portugal
2021/09/15 Electronic structure of the divacancy in 4H-SiC
(Thesis) Arguer
Gonçalo Lopes Carvalho de Matos Chaves (Master)
Universidade de Aveiro, Portugal
2018/07/25 Security analysis of quantum key distribution systems based on coherent states
(Thesis) Arguer
Vítor Hugo Paixão Ferreira (Master)
Universidade de Aveiro, Portugal

Interview (newspaper / magazine)

Activity description Newspaper / Forum
2022/07/28 MXenes à la Carte: Epitaxially grown MXene sandwiches with nitrogen sprinkles and metal topping CICECO News
2020/11/27 New projects secure almost half a million core.hours in Navigator cluster CICECO News
2019/12 CICECO researchers on the Mare Nostrum supercomputer Linhas UA

Mentoring / Tutoring

Topic Student name
2022/03/01 - 2022/03/15 Computational materials sciences for efficient water splitting with nanocrystals from abundant elements Eitan Yohanan
2019/01/07 - 2022/02/14 Carbon-based materials for the photodegradation of water pollutants Joana Lúcia Marto dos Santos Lopes
2019/01/07 - 2019/07/22 CO2 Dissociation as Catalysed by MXenes Raul Morales Salvador
Distinctions

Award

2014 European BEST Engineering Competition Aveiro 1st place
Wisemadness, Portugal
2014 European BEST Engineering Competition Final 2nd place
Deutsche Bahn AG, Germany
2014 European BEST Engineering Competition Portugal 1st place
EDP, Portugal
2013 European BEST Engineering Competition Aveiro 2nd place
Bosch Aveiro, Portugal
2012 European BEST Engineering Competition Aveiro 3rd place
Bosch Aveiro, Portugal
2009 D. Ana Caetano award for the best final-year student
Grupo Salvador Caetano, Portugal
2007 Bolsa de Estudo aos melhores Caloiros
Universidade de Aveiro, Portugal
2006 Bolsa de Estudo aos melhores Caloiros
Universidade de Aveiro, Portugal
2006 Best first-year student of science and technology
Universidade de Aveiro, Portugal
2005 Best first-year student of Physics
Universidade de Aveiro, Portugal