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I am an Assistant Professor at the Department of Materials and Ceramics Engineering of the University of Aveiro, having completed my PhD in 2013 in physical-chemistry from the University of Porto. Published 35 research papers (Scopus h-index = 14, 1st author: 14 papers, corresponding author: 4 papers) and 1 book. Gave 16 conference talks, co-authored 70 conference communications, supervised 11 students (1 BSc, 8 MSc, 1 Post-doc and 1 Junior Researcher), gave Thermodynamics lectures as a teaching assistant (2019), am presently responsible for the Machine Learning part of e-project in the FAME-AIS Erasmus Mundus Master program (https://www.fame-master.eu/), was involved in 15 research projects (6 European), and recently received 2 awards (2021 CICECO Young Researcher Award and best poster prize at the 14th Physical Chemistry National Meeting in 2021). I am currently interested in database curation, data mining, machine learning and development of digital applications, for corrosion protection, design of smart nanocontainers, and nanosafety (http://dx.doi.org/10.1080/15287394.2017.1331597). * I have experience as a PI, leading project DATACOR (Smart Data to Design Corrosion Inhibitors), which combines corrosion science, molecular modelling and machine learning to produce web applications capable of being used by other researchers to design more efficient and safer corrosion protection solutions. Thus far, along with other publications based on numerical modelling (http://dx.doi.org/10.1016/j.jcis.2016.01.038 (IF: 8.1); https://doi.org/10.3390/CMDWC2021-09935), project DATACOR has resulted in the first paper from CICECO focused on ML (https://doi.org/10.1021/acs.jpcc.9b09538, special machine learning issue), an open data management web tool (https://datacor.shinyapps.io/cordata/) and a machine learning based application (https://datacor.shinyapps.io/datacortech/), thus establishing a new interdisciplinary approach in CICECO. * From 2016 to 2019, I was a leading member of FCT project SELMA (Unveiling the self-healing mechanisms associated with smart nanocontainers), where density functional theory (DFT) and molecular dynamics were used to simulate the self-healing mechanisms associated with nanostructured coatings, resulting in publications in high impact factor journals, such as the Chemical Engineering Journal (IF 13.3, https://doi.org/10.1016/j.cej.2018.02.061). * Currently, I am a task leader in European project COAT4LIFE (2021-2025, https://coat4life.com/), being responsible for coordinating all the machine learning work to be performed in collaboration with Helmholtz-Zentrum hereon GmbH. COAT4LIFE is expected to produce machine learning models made available through web apps to design corrosion protection solutions. I am also a member of the Management Committee of the COST ACTION CA22143, named European Materials Informatics Network (EuMINe, 2023-2027, https://www.cost.eu/actions/CA22143/), where artificial intelligence proctocols for materials science will be developed.
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Identification

Personal identification

Full name
Tiago Luís Pereira Galvão

Citation names

  • Galvão, Tiago
  • Tiago L. P. Galvão

Author identifiers

Ciência ID
671B-DD1C-9002
ORCID iD
0000-0002-0685-3675
Researcher Id
D-1085-2011
Scopus Author Id
26631796500

Email addresses

  • tlpgalvao@ua.pt (Professional)

Addresses

  • DEMaC, Campus Universitário de Santiago, Universidade de Aveiro, 3810-164, Aveiro, Aveiro, Portugal (Professional)

Websites

Knowledge fields

  • Exact Sciences - Computer and Information Sciences
  • Engineering and Technology - Nano-technology - Nano-materials
  • Exact Sciences - Chemical Sciences - Physical Chemistry

Languages

Language Speaking Reading Writing Listening Peer-review
Portuguese (Mother tongue)
English Advanced (C1) Proficiency (C2) Proficiency (C2) Proficiency (C2) Advanced (C1)
Education
Degree Classification
2009/09/01 - 2013/12/06
Concluded
 Química (Doutoramento)
Universidade do Porto Faculdade de Ciências, Portugal
"Estudo termoquímico experimental e computacional de derivados da pirimidina // Experimental and computational thermochemical of pyrimidine derivatives" (THESIS/DISSERTATION)
 Approved with Distinction
2007/09/01 - 2009/07/31
Concluded
 Química (Mestrado integrado)
Universidade do Porto Faculdade de Ciências, Portugal
"Thermochemical study of dichloronitroanilines" (THESIS/DISSERTATION)
 17 out of 20
2004/09/01 - 2007/07/31
Concluded
 Química (Licenciatura)
Universidade do Porto Faculdade de Ciências, Portugal
 15 out of 20
Affiliation

Science

Category
Host institution 		Employer
2023/07/01 - 2024/01/31 Auxiliary Researcher (Research) Universidade de Aveiro, Portugal
2019/01/01 - 2023 Research Assistant (Research) Universidade de Aveiro CICECO, Portugal
2014/05/01 - 2018/12/31 Postdoc (Research) Universidade de Aveiro CICECO, Portugal

Teaching in Higher Education

Category
Host institution 		Employer
2024/02/01 - Current Assistant Professor (University Teacher) Universidade de Aveiro Departamento de Engenharia de Materiais e Cerâmica, Portugal

Others

Category
Host institution 		Employer
2017/08/01 - 2017/09/30 Coatings Engineer Universidade de Aveiro CICECO, Portugal
2016/07/01 - 2016/09/30 Coatings Engineer Synpo, Czech Republic
2016/01/01 - 2016/02/29 Coatings Engineer Synpo, Czech Republic
Projects

Grant

Designation Funders
2009/10/01 - 2013/09/30 ESTUDO TERMOQUÍMICO EXPERIMENTAL E COMPUTACIONAL DE DERIVADOS DA PIRIMIDINA
SFRH/BD/62231/2009
PhD Student Fellow
Universidade do Porto Faculdade de Ciências, Portugal
 Fundação para a Ciência e a Tecnologia
Concluded

Contract

Designation Funders
2023/10/24 - 2027/10/23 European Materials Informatics Network (EuMINe)
CA22143
Management committee
Universidade de Aveiro, Portugal
 European Cooperation in Science and Technology
Ongoing
2021/05 - 2025/04 COAT4LIFE - Eco-friendly corrosion protective coatings based on smart nanotechnology platforms for a circular economy
101007430
Task Leader (Task 5.1 - Machine learning modelling of corrosion protective technologies))
Universidade de Aveiro, Portugal
 European Commission
Ongoing
2023/02/15 - 2024/08/14 MXenes catalysts for the water gas shift reaction
2022.02949.PTDC
Task Leader (Task 3 - Screening of WGS descriptors and prediction of MXene catalytic activities)
Universidade de Aveiro, Portugal
 Fundação para a Ciência e a Tecnologia
Ongoing
2018/07 - 2022/07 DATACOR - Smart Data to Design Corrosion Inhibitors
PTDC/QUI-QFI/30256/2017
Principal investigator
Universidade de Aveiro, Portugal
 Fundação para a Ciência e a Tecnologia
Concluded
2018/10/20 - 2021/10/19 Novel Anthocyanin-Based Smart Sensors for Food Packaging.
PTDC/OCE-ETA/31250/2017
Researcher
Universidade de Aveiro, Portugal

Associação para a Inovação e Desenvolvimento da FCT, Portugal
Fundação para a Ciência e a Tecnologia
Ongoing
2018/03/01 - 2021/02/28 Desenvolvimento de camadas nanoestruturadas inteligentes para a deteção de corrosão em estruturas aquáticas
MARTERA/0004/2017
Universidade de Aveiro, Portugal

Universidade de Aveiro CICECO, Portugal
Fundação para a Ciência e a Tecnologia
Ongoing
2017/03 - 2021/02 SMARTAQUA - Development of SMART nanostructured layers for sensing corrosion in AQUAtic structures
ERA-NET MarTERA/0004/2017
Researcher
European Commission
2016/05 - 2019/04 SELMA - Unveiling the self-healing mechanisms associated with smart nanocontainers
PTDC/QEQ-QFI/4719/2014
Post-doc Fellow
Universidade de Aveiro CICECO, Portugal
 Portuguese National Funding Agency for Science, Research and Technology
Concluded
2015/01 - 2018/12 SMARCOAT - Development of Smart Nano and Microcapsulated Sensing Coatings for improving of Material Durability/Performance
H2020-MSCA-RISE-2014, ref.645662
Post-doc
European Commission
2015/01 - 2018/12 MULTISURF - MULTI-functional metallic SURFaces via active Layered Double Hydroxide treatments
H2020-MSCA-RISE-2014, 645676
Post-doc
European Commission
2015/07 - 2016/07 NANOBARRIER - Extended shelf-life biopolymers for sustainable and multifunctional food packaging solutions
FP7/2011-NMP4-LA-2012-280759
Post-doc Fellow
European Commission
2014/05 - 2015/06 FUNACOP – Nanomaterials for Application in Functional Coatings
FCOMP-01-0124-FEDER-38777
Post-doc Fellow
QREN
2013/06 - 2015/06 CONVPROTECT - Multifunctional Nanostructured Conversion Films Based on Layered Double Hydroxides for Corrosion Protection of Aeronautical Structures
PTDC/CTM-MAT/1515/2012
Post-doc
Portuguese National Funding Agency for Science, Research and Technology
2011/01/01 - 2012/12/31 Strategic Project - UI 81 - 2011-2012
PEst-C/QUI/UI0081/2011
PhD Student Fellow
Universidade do Porto Centro de Investigação em Química, Portugal

Universidade do Porto Faculdade de Ciências, Portugal
Fundação para a Ciência e a Tecnologia
Concluded
2007/09 - 2009/08 NANOTEXTUP - Novel Functionalised Textiles through Nanostructured Carbon and Clay based Materials
IPG63
Scientific Initiation Fellow
University of Porto, Ilídio Pinho Foundation and Caixa Geral de Depósitos
Outputs

Publications

Book
  1. Tiago L. P. Galvão. Short notes on thermodynamics and physical chemistry. United States. 2018.
Book chapter
  1. Galvão, T.L.P.; Wilhelm, M.; Gomes, J.R.B.; Tedim, J.; Galvão, Tiago. "Emerging trends in smart nanocontainers for corrosion applications". 385-398. 2019.
    10.1016/b978-0-12-816770-0.00022-8
  2. Galvão, T.L.P.; C. Bouali, A.; Serdechnova, M.; Yasakau, K.A.; Zheludkevich, M.L.; Tedim, J.; Galvão, Tiago. "Anticorrosion thin film smart coatings for aluminum alloys". 429-454. 2019.
    10.1016/b978-0-12-849870-5.00007-0
Conference paper
  1. Tiago L. P. Galvão; Gerard Novell-Leruth; Inês Ferreira; Alena Kuznetsova; José R. B. Gomes; João Tedim. "Data Science Framework to Select Corrosion Inhibitors". 2021.
    10.3390/CMDWC2021-09935
Conference poster
  1. Tiago L. P. Galvão; Kuznetsova, Alena; Neves, Cristina; Tedim, João; Ferreira, M.G.S.; Gomes, J.R.B.. Corresponding author: Tiago L. P. Galvão. "Unraveling the dynamic interplay between the local structure and properties of layered double hydroxides by computer simulation". Paper presented in Jornadas CICECO 2018 -Living Science together, 2018.
  2. Tiago L. P. Galvão; Neves, Cristina; G. Perez-Sanchez; Ofoegbu, S. U.; Gomes, J.R.B.; Tedim, João; Ferreira, M. G.S.. Corresponding author: Tiago L. P. Galvão. "How Molecular Modelling is used to Gain Insights into Corrosion Protection". Paper presented in UA Research Day 2017, 2017.
  3. Tiago L. P. Galvão; Neves, Cristina; Diogo Mata; Eliana Malheiro; Maria Ferreira; Tedim, João; Ferreira, M.G.S.. Corresponding author: Tiago L. P. Galvão. "Physicochemical underpinnings behind the synthesis of layered double hydroxides:optimization of the upscaling conditions". Paper presented in Materiais 2015: VII International Materials symposium, 2015.
  4. Tiago L. P. Galvão; Neves, Cristina; Carneiro, J.; Kuznetsova, Alena; Bastos, A.C.; Zheludkevich, M.L.; Gomes, J.R.B.; Tedim, João; Ferreira, M.G.S.. Corresponding author: Tiago L. P. Galvão. "Insights into the corrosion inhibition mechanism of 2-mercaptobenzothiazole on an aluminium surface: from electrochemistry to atomistic computer simulations". Paper presented in VII Aluminium Surface Science & Technology - ASST, 2015.
Journal article
  1. Marta Bordonhos; Tiago L. P. Galvão; José R. B. Gomes; José D. Gouveia; Miguel Jorge; Mirtha A. O. Lourenço; José M. Pereira; et al. "Multiscale Computational Approaches toward the Understanding of Materials". Advanced Theory and Simulations (2022): https://doi.org/10.1002/adts.202200628.
    10.1002/adts.202200628
  2. João Tedim; Tiago L. P. Galvão; Kiryl A. Yasakau; Alexandre Bastos; José R. B. Gomes; Mario G. S. Ferreira. "Layered double hydroxides for corrosion-related applications—Main developments from 20 years of research at CICECO". Frontiers in Chemistry (2022): http://dx.doi.org/10.3389/fchem.2022.1048313.
    10.3389/fchem.2022.1048313
  3. Gerard Novell Leruth; Alena Kuznetsova; João Tedim; José R. B. Gomes; Tiago L. P. Galvão. "Molecular Dynamics Model to Explore the Initial Stages of Anion Exchange involving Layered Double Hydroxide Particles". Nanomaterials (2022): https://doi.org/10.3390/nano12224039.
    10.3390/nano12224039
  4. Tiago L. P. Galvão; Inês Ferreira; Alena Kuznetsova; Gerard Novell-Leruth; Ci Song; Christian Feiler; Sviatlana V. Lamaka; et al. "CORDATA: an open data management web application to select corrosion inhibitors". npj Materials Degradation (2022): https://doi.org/10.1038/s41529-022-00259-9.
    10.1038/s41529-022-00259-9
  5. Tiago L. P. Galvão. "Hexacyanoferrate-intercalated layered double hydroxides as a nanoadditive for detection of early-stage corrosion of steel: the revival of Prussian Blue". European Journal of Inorganic Chemistry (2020): http://dx.doi.org/10.1002/ejic.202000144.
    10.1002/ejic.202000144
  6. Tiago L. P. Galvão; Gerard Novell-Leruth; Alena Kuznetsova; João Tedim; José R. B. Gomes. "Elucidating Structure–Property Relationships in Aluminum Alloy Corrosion Inhibitors by Machine Learning". The Journal of Physical Chemistry C (2020): https://doi.org/10.1021/acs.jpcc.9b09538.
    10.1021/acs.jpcc.9b09538
  7. Novell-Leruth, G.; Pérez-Sánchez, G.; Galvão, T.L.P.; Boiba, D.; Poznyak, S.; Carneiro, J.; Tedim, J.; Gomes, J.R.B.. "Unveiling the local structure of 2-mercaptobenzothiazole intercalated in (Zn2Al) layered double hydroxides". Applied Clay Science 198 (2020): http://www.scopus.com/inward/record.url?eid=2-s2.0-85091246498&partnerID=MN8TOARS.
    10.1016/j.clay.2020.105842
  8. Galvão, T.L.P.; Scharnagl, N.; Sousa, I.; Maia, F.; Wilhelm, M.; Gomes, J.R.B.; Opršal, J.; et al. "Nanostructured corrosion sensing coatings for aeronautical applications". 2018-April (2018): http://www.scopus.com/inward/record.url?eid=2-s2.0-85053492163&partnerID=MN8TOARS.
  9. Pérez-Sánchez, G.; Galvão, T.L.P.; Tedim, J.; Gomes, J.R.B.. "Corrigendum to “A molecular dynamics framework to explore the structure and dynamics of layered double hydroxides” [Appl. Clay Sci., 163, 164-177] (Applied Clay Science (2018) 163 (164–177), (S0169131718302916), (10.1016/j.clay.2018.06.037))". Applied Clay Science 166 (2018): 339-339. http://www.scopus.com/inward/record.url?eid=2-s2.0-85054672093&partnerID=MN8TOARS.
    10.1016/j.clay.2018.09.024
  10. Galvão, T.L.P.; Sousa, I.; Wilhelm, M.; Carneiro, J.; Opršal, J.; Kukacková, H.; Špacek, V.; et al. "Improving the functionality and performance of AA2024 corrosion sensing coatings with nanocontainers". Chemical Engineering Journal 341 (2018): 526-538. http://www.scopus.com/inward/record.url?eid=2-s2.0-85044713490&partnerID=MN8TOARS.
    10.1016/j.cej.2018.02.061
  11. Pérez-Sánchez, G.; Galvão, T.L.P.; Tedim, J.; Gomes, J.R.B.. "A molecular dynamics framework to explore the structure and dynamics of layered double hydroxides". Applied Clay Science 163 (2018): 164-177. http://www.scopus.com/inward/record.url?eid=2-s2.0-85050121967&partnerID=MN8TOARS.
    10.1016/j.clay.2018.06.037
  12. Sousa, I.; Kuznetsova, A.; Galvão, T.; Carneiro, J.; Reyes, M.; Bastos, A.; Tedim, J.; Ferreira, M.G.S.. "The use of nanostructured materials loaded with pH indicating molecules for corrosion sensing". 8 (2017): http://www.scopus.com/inward/record.url?eid=2-s2.0-85027989641&partnerID=MN8TOARS.
  13. Ofoegbu, S.U.; Galvão, T.L.P.; Gomes, J.R.B.; Tedim, J.; Nogueira, H.I.S.; Ferreira, M.G.S.; Zheludkevich, M.L.. "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". Physical Chemistry Chemical Physics 19 8 (2017): 6113-6129. http://www.scopus.com/inward/record.url?eid=2-s2.0-85027014279&partnerID=MN8TOARS.
    10.1039/c7cp00241f
  14. Galvao, T.L.P.; Neves, C.S.; Zheludkevich, M.L.; Gomes, J.R.B.; Tedim, J.; Ferreira, M.G.S.. "How Density Functional Theory Surface Energies May Explain the Morphology of Particles, Nanosheets, and Conversion Films Based on Layered Double Hydroxides". Journal of Physical Chemistry C 121 4 (2017): 2211-2220. http://www.scopus.com/inward/record.url?eid=2-s2.0-85027329299&partnerID=MN8TOARS.
    10.1021/acs.jpcc.6b10860
  15. Mesquita, B.; Lopes, I.; Silva, S.; Bessa, M.J.; Starykevich, M.; Carneiro, J.; Galvão, T.L.P.; et al. "Gold nanorods induce early embryonic developmental delay and lethality in zebrafish (Danio rerio)". Journal of Toxicology and Environmental Health - Part A: Current Issues (2017): 1-16. http://www.scopus.com/inward/record.url?eid=2-s2.0-85023174720&partnerID=MN8TOARS.
    10.1080/15287394.2017.1331597
  16. Galvão, T.L.P.; Kuznetsova, A.; Gomes, J.R.B.; Zheludkevich, M.L.; Tedim, J.; Ferreira, M.G.S.. "A computational UV–Vis spectroscopic study of the chemical speciation of 2-mercaptobenzothiazole corrosion inhibitor in aqueous solution". Theoretical Chemistry Accounts 135 3 (2016): http://www.scopus.com/inward/record.url?eid=2-s2.0-84959547884&partnerID=MN8TOARS.
    10.1007/s00214-016-1839-3
  17. Szterner, P.; Galvão, T.L.P.; Amaral, L.M.P.F.; Ribeiro Da Silva, M.D.M.C.; Ribeiro Da Silva, M.A.V.. "5-Isopropylbarbituric and 2-thiobarbituric acids: An experimental and computational study". Thermochimica Acta 625 (2016): 36-46. http://www.scopus.com/inward/record.url?eid=2-s2.0-84953205988&partnerID=MN8TOARS.
    10.1016/j.tca.2015.12.007
  18. Galvão, T.L.P.; Neves, C.S.; Caetano, A.P.F.; Maia, F.; Mata, D.; Malheiro, E.; Ferreira, M.J.; et al. "Control of crystallite and particle size in the synthesis of layered double hydroxides: Macromolecular insights and a complementary modeling tool". Journal of Colloid and Interface Science 468 (2016): 86-94. http://www.scopus.com/inward/record.url?eid=2-s2.0-84961305246&partnerID=MN8TOARS.
    10.1016/j.jcis.2016.01.038
  19. Szterner, P.; Galvão, T.L.P.; Amaral, L.M.P.F.; Ribeiro Da Silva, M.D.M.C.; Ribeiro Da Silva, M.A.V.. "Thermochemistry of 6-propyl-2-thiouracil: An experimental and computational study". Thermochimica Acta 588 (2014): 68-74. http://www.scopus.com/inward/record.url?eid=2-s2.0-84901426446&partnerID=MN8TOARS.
    10.1016/j.tca.2014.04.018
  20. Galvão, T.L.P.; Rocha, I.M.; Ribeiro Da Silva, M.D.M.C.; Ribeiro Da Silva, M.A.V.. "Energetic study of 4(3 H)-pyrimidinone: Aromaticity of reactions, hydrogen bond rules, and support for an anomeric effect". Journal of Physical Chemistry A 118 18 (2014): 3360-3366. http://www.scopus.com/inward/record.url?eid=2-s2.0-84900415280&partnerID=MN8TOARS.
    10.1021/jp502468s
  21. Galvão, T.L.P.; Ribeiro Da Silva, M.D.M.C.; Ribeiro Da Silva, M.A.V.. "From 2,4-dimethoxypyrimidine to 1,3-dimethyluracil: Isomerization and hydrogenation enthalpies and noncovalent interactions". Journal of Physical Chemistry A 118 26 (2014): 4816-4823. http://www.scopus.com/inward/record.url?eid=2-s2.0-84903794006&partnerID=MN8TOARS.
    10.1021/jp503412u
  22. Rocha, I.M.; Galvão, T.L.P.; Ribeiro Da Silva, M.D.M.C.; Ribeiro Da Silva, M.A.V.. "Thermodynamic study of chlorobenzonitrile isomers: A survey on the polymorphism, pseudosymmetry, and the chloro···cyano interaction". Journal of Physical Chemistry A 118 8 (2014): 1502-1510. http://www.scopus.com/inward/record.url?eid=2-s2.0-84897662080&partnerID=MN8TOARS.
    10.1021/jp410187q
  23. Lima, C.F.R.A.C.; Costa, J.C.S.; Galvão, T.L.P.; Tavares, H.R.; Silva, A.M.S.; Santos, L.M.N.B.F.. "Self-association of oligothiophenes in isotropic systems". Physical Chemistry Chemical Physics 16 28 (2014): 14761-14770. http://www.scopus.com/inward/record.url?eid=2-s2.0-84903551629&partnerID=MN8TOARS.
    10.1039/c4cp01101e
  24. Rocha, I.M.; Galvão, T.L.P.; Ribeiro Da Silva, M.D.M.C.; Ribeiro Da Silva, M.A.V.. "Energetic study of bromobenzonitrile isomers: Insights on the intermolecular interactions, aromaticity and electronegativity". Structural Chemistry 24 6 (2013): 1935-1944. http://www.scopus.com/inward/record.url?eid=2-s2.0-84889090532&partnerID=MN8TOARS.
    10.1007/s11224-013-0278-1
  25. Galvão, T.L.P.; Ribeiro Da Silva, M.D.M.C.; Ribeiro Da Silva, M.A.V.. "Energetics of aminomethylpyrimidines: An examination of the aromaticity of nitrogen heteromonocyclic derivatives". Journal of Chemical Thermodynamics 62 (2013): 186-195. http://www.scopus.com/inward/record.url?eid=2-s2.0-84876473786&partnerID=MN8TOARS.
    10.1016/j.jct.2013.03.010
  26. Rocha, I.M.; Galvão, T.L.P.; Sapei, E.; Ribeiro Da Silva, M.D.M.C.; Ribeiro Da Silva, M.A.V.. "Levoglucosan: A calorimetric, thermodynamic, spectroscopic, and computational investigation". Journal of Chemical and Engineering Data 58 6 (2013): 1813-1821. http://www.scopus.com/inward/record.url?eid=2-s2.0-84879085347&partnerID=MN8TOARS.
    10.1021/je400207t
  27. Galvão, T.L.P.; Rocha, I.M.; Ribeiro Da Silva, M.D.M.C.; Ribeiro Da Silva, M.A.V.. "Is uracil aromatic? the enthalpies of hydrogenation in the gaseous and crystalline phases, and in aqueous solution, as tools to obtain an answer". Journal of Physical Chemistry A 117 28 (2013): 5826-5836. http://www.scopus.com/inward/record.url?eid=2-s2.0-84880532365&partnerID=MN8TOARS.
    10.1021/jp404938u
  28. Galvão, T.L.P.; Rocha, I.M.; Ribeiro Da Silva, M.D.M.C.; Ribeiro Da Silva, M.A.V.. "From 2-hydroxypyridine to 4(3 H)-pyrimidinone: Computational study on the control of the tautomeric equilibrium". Journal of Physical Chemistry A 117 47 (2013): 12668-12674. http://www.scopus.com/inward/record.url?eid=2-s2.0-84888988885&partnerID=MN8TOARS.
    10.1021/jp410004x
  29. Ribeiro Da Silva, M.A.V.; Galvão, T.L.P.; Rocha, I.M.; Santos, A.F.L.O.M.. "Aromaticity and stability going in opposite directions: An energetic, structural, magnetic and electronic study of aminopyrimidines". Journal of Chemical Thermodynamics 54 (2012): 330-338. http://www.scopus.com/inward/record.url?eid=2-s2.0-84863718977&partnerID=MN8TOARS.
    10.1016/j.jct.2012.05.015
  30. Ribeiro da Silva, M.A.V.; Ribeiro da Silva, M.D.M.C.; Santos, A.F.L.O.M.; Ferreira, A.I.M.C.L.; Galvão, T.L.P.. "Experimental thermochemical study of two chlorodinitroaniline isomers". Journal of Chemical Thermodynamics 42 4 (2010): 496-501. http://www.scopus.com/inward/record.url?eid=2-s2.0-75849144526&partnerID=MN8TOARS.
    10.1016/j.jct.2009.11.003
  31. Ribeiro da Silva, M.A.V.; Ribeiro da Silva, M.D.M.C.; Lobo Ferreira, A.I.M.C.; Santos, A.F.L.O.M.; Galvão, T.L.P.. "Experimental thermochemical study of 4,5-dichloro-2-nitroaniline". Journal of Chemical Thermodynamics 41 11 (2009): 1247-1253. http://www.scopus.com/inward/record.url?eid=2-s2.0-69049117159&partnerID=MN8TOARS.
    10.1016/j.jct.2009.05.013
  32. Ribeiro da Silva, M.A.V.; Lobo Ferreira, A.I.M.C.; Cabral, J.I.T.A.; Santos, A.F.L.O.M.; Moreno, A.R.G.; Galvão, T.L.P.; Rocha, I.M.; et al. "Experimental and computational thermochemical study of the tri-, tetra-, and pentachloronitrobenzene isomers". Journal of Chemical Thermodynamics 41 9 (2009): 984-991. http://www.scopus.com/inward/record.url?eid=2-s2.0-67349109120&partnerID=MN8TOARS.
    10.1016/j.jct.2009.03.014
  33. Ribeiro da Silva, M.A.V.; Ribeiro da Silva, M.D.M.C.; Lobo Ferreira, A.I.M.C.; Santos, A.F.L.O.M.; Galvão, T.L.P.. "Experimental thermochemical study of 2,5- and 2,6-dichloro-4-nitroanilines". Journal of Chemical Thermodynamics 41 10 (2009): 1074-1080. http://www.scopus.com/inward/record.url?eid=2-s2.0-67649210767&partnerID=MN8TOARS.
    10.1016/j.jct.2009.04.012
Online resource
  1. Tiago L. P. Galvão. DATACORTECH - Artificial intelligence virtual screen of potential corrosion inhibitors for the protection of aluminum alloys. 2022. https://datacor.shinyapps.io/datacortech/.
  2. Tiago L. P. Galvão. CORDATA - An open data management app to select appropriate corrosion inhibitors for specific application conditions. 2021. https://datacor.shinyapps.io/cordata/.

Other

Dataset
  1. Tiago L. P. Galvão. DATACOR Dataset V2 - for article Elucidating Structure–Property Relationships in Aluminum Alloy Corrosion Inhibitors by Machine Learning.
    10.17632/V5P322M2T8.2
Activities

Oral presentation

Presentation title Event name
Host (Event location)
2023/02/17 Data Driven Cloud Applications to Accelerate the Development of Corrosion Protection Technologies
Chinese Academy of Engineering (Hangzhou, China)
2021/11/02 Materials Data Science
University of Aveiro (Aveiro, Portugal)
2021/09/19 Development of nanoadditives for detection of early-stage corrosion of carbon steel Eurocorr 2021
(Budapest, Hungary)
2021/05/17 Data Science Framework to Select Corrosion Inhibitors 1st Corrosion and Materials Degradation Web Conference
(Switzerland)
2021/03/29 Data Driven Tools to Select Corrosion Inhibitors 14º Physical Chemistry National Meeting
(Portugal)
2019/09/09 Computational and data guided approaches to understand corrosion inhibitors Tiago L. P. Galvão, Gerard Novell-Leruth, Stanley U. Ofoegbu, Mikhail L. Zheludkevich, Mário G. S. Ferreira, João Tedim, José R. B. Gomes Eurocorr 2019
(Seville, Spain)
2019/07/09 DataCor: Smart Data to Design Corrosion Inhibitors Tiago L. P. Galvão, Gerard Novell-Leruth, Alena Kuznetsova, João Tedim, José R. B. Gomes Computer Modelling and Simulation Day 2019
(Aveiro, Spain)
2019/06/13 Computer simulation of Zn-Al layered double hydroxides with intercalated anions Tiago L. P. Galvão, José R. B. Gomes, Germán Pérez-Sánchez, Gerard Novell-Leruth, Alena Kuznetsova, Cristina S. Neves, João Tedim Univerisity of Aveiro and Helmholtz Zentrum Geesthacht joint Summer School “Metallic Materials Design via Engineered Interfaces: from inner interfaces to functional coatings”
(Aveiro, Portugal)
2019 Molecular dynamics study of layered double hydroxides Gerard Novell-Leruth, Germán Pérez-Sánchez, Tiago L. P. Galvão, Dziyana Boiba, Sergey Poznyak, João Tedim, José R. B. Gomes Computer Modelling and Simulation Day 2019
(Aveiro, Portugal)
2018/07/24 Corrosion Sensing for Mg alloys by Nanocontainer including Coatings Nico Scharnagl, Vinodh Korrapati, Frederico Maia, Diogo Mata, Vladimír Špacek, Tiago Galvão and João Tedim The 11th International Conference on Magnesium Alloys and Their Applications
(Beaumont Estate, Old Windsor, United Kingdom)
2018/05/27 Investigation of corrosion sensing using pH indicating molecules as a route towards the development of novel functional additives M. Reyes, T. Galvão, M. Wilhelm, A. Karotkaya, I. Sousa, A. Bastos, M.G.S. Ferreira, S.K. Poznyak, J. Tedim Aluminium Surface Science and Technology 2018
(Helsingør, Denmark)
2018/04/15 Nanostructured corrosion sensing coatings for aeronautical applications T.L.P. Galvão, I. Sousa, M. Wilhelm, J. Opršal, H. Kukacková, V. Špacek, N. Scharnagl, F. Maia, J. R. B. Gomes, M. G. S. Ferreira, João Tedim NACE 2018
(Phoenix, Arizona, United States)
2017/09/22 SMARCOAT: Development of Corrosion Sensing Smart Coatings Synpo
(Pardubice, Czech Republic)
2017/09/11 Molecular dynamics simulations of Zn–Al layered double hydroxides with different intercalated ions G. Pérez-Sánchez, Tiago L. P. Galvão, José R. B. Gomes, Joao Tedim CCP5 Annual General Meeting - Materials modelling: Simulation Meets Experiment 2017
(Glasgow, Scotland, United Kingdom)
2017/09/03 Molecular modeling of self-healing layered double hydroxide particles and conversion films Tiago L. P. Galvão, Cristina S. Neves, Germán Pérez-Sánchez, Stanley Udochukwu Ofoegbu, Mikhail L. Zheludkevich, José R. B. Gomes, João Tedim, Mário G. S. Ferreira EUROCORR 2017
(Prague, Czech Republic)
2017/09/03 Development of nanostructured additives for detection of corrosion in alloys used in aeronautical applications I. Sousa, T. Galvão, M. Wilhelm, A.C. Bastos, N. Scharnagl, V. Spacek, F. Maia, J. Tedim, M.G. Ferreira EUROCORR 2017
(Prague, Czech Republic)
2017/03/26 The use of nanostructured materials loaded with pH indicating molecules for corrosion sensing I. Sousa, A. Kuznetsova, T. Galvão, J. Carneiro, M. Reyes, A. Bastos, J. Tedim, M.G.S. Ferreira NACE Corrosion 2017
(New Orleans, United States)
2017/03/03 Molecular Modelling in Corrosion Protection and Self-healing Materials Tiago L. P. Galvão Molecular Modeling and Simulation Day 2017
(Aveiro, Portugal)
2016/06/22 A Computational Perspective of the Formation, Structure and Morphology of Layered Double Hydroxides Tiago L. P. Galvão, Cristina S. Neves, Ana P. F. Caetano, Alena Kuznetsova, Alexandre C. Bastos, Andrei Salak, José R. B. Gomes, João Tedim, Mário G.S. Ferreira XXII Physical-Chemistry National Meeting / I Computational Chemistry Symposium
(Évora, Portugal)
2016/06/08 Using Computational Tools to Understand the Formation and Processes of Layered Double Hydroxides Tiago L. P. Galvão, Cristina S. Neves, Ana P. F. Caetano, Alena Kuznetsova, Alexandre C. Bastos, Andrei Salak, José R. B. Gomes, João Tedim, Mário G.S. Ferreira CICECO Meeting 2016
(Aveiro, Portugal)
2015/10/05 Synthesis of Layered Double Hydroxides: Macromolecular Insights and a Modeling approach Tiago L. P. Galvão, Cristina S. Neves, Ana P. F. Caetano, Frederico Maia, Diogo Mata, Eliana Malheiro, Maria J. Ferreira, Alexandre C. Bastos, Andrei Salak, José R. B. Gomes, João Tedim, Mário G.S. Ferreira FM&NT-2015: Functional Materials and Nanotechnologies
(Vilnius, Lithuania)
2015/09/27 Modeling of fast pyrolysis of wood for prediction of bio-oil composition Thomas Kohl, Erlin Sapei, Inês M. Rocha, Tiago L.P. Galvão, Maria D.M.C. Ribeiro da Silva, Manuel A.V. Ribeiro da Silva APCChE 2015
(Melbourne, Australia)
2015/06/25 Why Organic Corrosion Inhibitors Inhibit? The Case of 2-Mercaptobenzothiazole Adsorption onto an Al(111) Surface Tiago L.P. Galvão Computational Approaches to Materials Design 2015
(Aveiro, Portugal)
2015/05/17 Insights into the Corrosion Inhibition Mechanism of 2-Mercaptobenzothiazole on an Aluminium Surface: from Electrochemistry to Atomistic Computer Simulations Tiago L.P. Galvão, Cristina S. Neves, Jorge Carneiro, Alena I. Kuznetsova, Alexandre C. Bastos, Mikhail L. Zheludkevich, José R.B. Gomes, João Tedim, Mário G. S. Ferreira ASST 2015: VII Aluminium Surface Science & Technology
(Madeira, Portugal)
2014/11/16 Modeling and Thermodynamic Properties Measurements of Levoglucosan for Process Design, Simulation, and Optimization in the Production of Pyrolitic Biofuel Erlin Sapei, Tiago L.P. Galvão, Inês M. Rocha, Maria D.M.C. Ribeiro da Silva, and Manuel A.V. Ribeiro da Silva 2014 AIChE Annual Meeting
(Atlanta, GA, United States)
2014/09/28 Comprehensive Thermophysical Properties Measurements of Levoglucosan for Design of Pyrolytic Process in Biorefinery Erlin Sapei, Inês M. Rocha, Tiago L.P. Galvão, Maria D.M.C. Ribeiro da Silva, and Manuel A.V. Ribeiro da Silva Chemeca 14
(Perth, Western Australia, Australia)
2014/08/31 Self-association of oligothiophenes in isotropic systems Carlos F. R. A. C. Lima, José C. S. Costa, Tiago L. P. Galvão, Artur M. S. Silva, Hilário R. Tavares, Luís M. N. B. F. Santos ECTP 2014 – 20th European Conference on Themophysical Properties
(Porto, Portugal)
2012/09/09 Enthalpy of Hydrogenation of Uracil Tiago L.P. Galvão, Manuel A.V. Ribeiro da Silva ICPOC21 – 21st IUPAC International Conference on Physical Organic Chemistry
(Durham University, United Kingdom)
2011/11/14 Energetic Study of Hydroxypyrimidines: the Relation with Structure Tiago L.P. Galvão
(Lisbon, Portugal)
2011/07/24 Experimental and Computational Thermochemistry of Substituted Pyrimidines with Amino and Methyl Substituents Tiago L.P. Galvão, Manuel A.V. Ribeiro da Silva MEDICTA 2011 – 10th Mediterranean conference on calorimetry and thermal analysis
(Porto, Portugal)
2008/02/20 Novel Functionalized Textiles through Nanostructured Carbon and Clay Based Materials Inês M. Rocha, Tiago L.P. Galvão, Clara Pereira, Cristina Freire, F. Pereira IJUP 08 – Meeting of Young Chemical Researchers of the University of Porto
(Porto, Portugal)

Supervision

Thesis Title
Role 		Degree Subject (Type)
Institution / Organization
2023/05/01 - 2024/10/31 ForTheShift - MXenes catalysts for the water gas shift reaction
Co-supervisor of Kais Iben Nassar
 Post-doc fellowship (Other)
Universidade de Aveiro CICECO, Portugal
2022/10/01 - 2023/10/31 Artificial intelligence and materials design: Application of machine learning techniques to analyze the synthesis of nanostructured lamellar materials applied in functional coatings
Supervisor of Gabriel Martins
 Materials Engineering (Master)
Universidade de Aveiro Departamento de Engenharia de Materiais e Cerâmica, Portugal
2019 - 2022 Junior Researcher hired in the frame of Project DATACOR - Smart Data to Design Corrosion Inhibitors
Supervisor of Dr. Gerard Novell-Leruth
 Computational Chemistry (Other)
Universidade de Aveiro CICECO, Portugal
2020/11/01 - 2021/09/30 Selection of corrosion inhibitors for aeronautical applications using machine learning
Supervisor of Inês Ferreira
 Materials Engineering (Master)
Universidade de Aveiro, Portugal
2019 - 2021 PhD student hired in frame of Project DATACOR - Smart Data to Design Corrosion Inhibitors
Co-supervisor of Alena Kuznetsova
 Materials Engineering (PhD)
Universidade de Aveiro, Portugal
2018 - 2018 "Development of Smart Nano and Microcapsulated Sensing Coatings for improving of Material Durability/Performance" - Visiting staff from Belarus State University in the frame of EU project SMARCOAT In partnership with company Smallmatek
Co-supervisor of Alesia Sushkova, MSc
 Materials Engineering (Master)
Universidade de Aveiro, Portugal
2018 - 2018 Rheology study of layered double hydroxides nanocontainers
Co-supervisor of André Vieira
 Ciências de Engenharia de Materiais (Degree)
Universidade de Aveiro, Portugal
2017 - 2018 "Influence of additives used in different formulations of flexible PVC in the adhesion between layers of garden hoses"
Co-supervisor of Marina Sousa Torres
 Ciência e Engenharia de Materiais (Master)
Universidade de Aveiro, Portugal
2017 - 2018 "Development of Smart Nano and Microcapsulated Sensing Coatings for improving of Material Durability/Performance" - Visiting staff from Belarus State University in the frame of EU project SMARCOAT In partnership with company SMALLMATEK
Co-supervisor of Dziyana Boiba
Universidade de Aveiro, Portugal
2016 - 2016 "Development of Smart Nano and Microcapsulated Sensing Coatings for improving of Material Durability/Performance" Visiting staff from Synpo (Czech Republic) in the frame of EU project SMARCOAT
Co-supervisor of Katerina Prouzová
2016 - 2016 "Development of Smart Nano and Microcapsulated Sensing Coatings for improving of Material Durability/Performance" - Visiting staff from Synpo (Czech Republic) in the frame of EU project SMARCOAT
Co-supervisor of Jakub Oprsal, PhD student
Universidade de Aveiro, Portugal

Consulting

Activity description Institution / Organization
2019/01/01 - Current Principal Investigator in project DATACOR Universidade de Aveiro CICECO, Portugal
2014/05/01 - 2018/12/31 - Research in materials science and computational chemistry to obtain new self-healing and sensing coatings capable of going to the market through our industrial partners. - I use computational chemistry and machine learning to unveil the corrosion protection mechanism of mettalic surfaces. Universidade de Aveiro CICECO, Portugal
2017/08/01 - 2017/09/30 - A bifunctional coating system for corrosion protection and sensing based on layered double hydroxides was formulated and tested. Synpo, Czech Republic
2016/07/01 - 2016/09/30 - In the frame of the project SMARCOAT, I optimized the compatibility of silica nanocapsules with phenolphthalein encapsulated with polymeric high performance coating formulations produced at SYNPO. - The proof of concept of sensing coatings was demonstrated for one system. Synpo, Czech Republic
2016/02/01 - 2016/02/29 - In the frame of the project SMARCOAT, the compatibility of macromolecular containers based on layered double hydroxides produced at SMALLMATEK were optimized for four polymeric high performance coating formulations produced at SYNPO. - Two coating systems with layered double hydroxides to enhance active corrosion protection are ready to go to the market. Universidade de Aveiro CICECO, Portugal

Course / Discipline taught

Academic session Degree Subject (Type) Institution / Organization
2022/10/01 - 2023/05/31 e-Project 2022: Design of a piezoelectric energy harversting device; Responsible for Part 5 (Machine Learning) - Piezoelectric material selection to optimize your device Functional Advanced Materials Engineering with Artificial Intelligence for Sustainability (FAME-AIS) (Master) Universidade de Aveiro, Portugal

Université catholique de Louvain, Belgium

Université Grenoble Alpes Grenoble INP Institut d¿Ingénierie et de Management, France

Technische Universität Darmstadt, Germany

Universität Augsburg, Germany

Université de Bordeaux, France

Université de Liège, Belgium
2019/10 - 2019/12 Thermodynamics teaching assistant Electrical Engineering (Bacharelato) Universidade de Aveiro Escola Superior de Tecnologia e Gestão de Águeda, Portugal

Evaluation committee

Activity description
Role 		Institution / Organization Funding entity
2023 - 2023 Took part in the evaluation process of AAPG 2023 of the French National Research Agency (ANR) as a Scientific Expert for the scientific panel CE08 - Metallic and inorganic materials.
Evaluator
 Universidade de Aveiro, Portugal Agence nationale de la recherche
Distinctions

Award

2021 2021 CICECO Young Researcher Award
Universidade de Aveiro CICECO, Portugal
2021 Best poster award - 14th Physical Chemistry National Meeting
Sociedade Portuguesa de Química, Portugal
2013 Travel grant for Science Management Summer School
Education Audiovisual and Culture Executive Agency, Belgium
2011 Best poster award by the European Young Chemists Network
European Young Chemists' Network, Belgium
2009 PhD research grant from the Foundation for Science and Technology
Fundação para a Ciência e a Tecnologia, Portugal
2008 Travel grant from Hovione
Hovione, Portugal

Other distinction

2013 Paper selected for the cover of the Journal of Chemical and Engineering Data
American Chemical Society, United States
2012 Poster selected for flash Oral Communication during the 21st IUPAC International Conference on Physical Organic Chemistry
International Union of Pure and Applied Chemistry, United States