Projects per year
Personal profile
Expertise related to UN Sustainable Development Goals
In 2015, UN member states agreed to 17 global Sustainable Development Goals (SDGs) to end poverty, protect the planet and ensure prosperity for all. This person’s work contributes towards the following SDG(s):
Education/Academic qualification
Ph. D., Doctor in Theoretical and Computational Chemistry , Universitat Autònoma de Barcelona (UAB)
Award Date: 8 Mar 2007
Masters, Master in Theoretical and Computational Chemistry, Universitat Autònoma de Barcelona (UAB)
Award Date: 22 Dec 2003
Degree, Degree in Chemistry, Universitat Autònoma de Barcelona (UAB)
Award Date: 19 Sept 2002
External positions
Investigador Postdoctoral, University of Turin
1 Oct 2007 → 30 Nov 2009
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Collaborations and top research areas from the last five years
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CHAOS: Computational Studies on Heterogeneous Astrocatalysis of Space-Abundant Transition Metals
Rimola Gibert, A. (Principal Investigator) & Pareras Niell, G. (Beneficiary)
European Commission (EC), MSCA Postdoctoral Fellowship
1/09/24 → 31/08/26
Project: International research project
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Projecte: Química prebiótica en entornos de formación planetarias. Una aproximación computacional de alto rendimiento
Rimola Gibert, A. (Principal Investigator)
Ministerio de Ciencia e Innovación (MICINN)
1/04/24 → 30/06/26
Project: Research Projects and Other Grants
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HETEROGENEOUS ASTROCATALYSIS OF SPACE-ABUNDANT TRANSITION METALS. A COMPUTATIONAL APPROACH
Rimola Gibert, A. (Principal Investigator), Luque Urrutia, J. A. (Collaborator), Enrique-Romero, J. (Collaborator), Kakkar , H. (Collaborator), Perrero ., J. (Collaborator), Martinez i Bachs, B. (Collaborator) & Ferrero , S. (Collaborator)
1/09/22 → 31/08/25
Project: Research Projects and Other Grants
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QUANTUMGRAIN: Quantum Chemistry on Interstellar Grains
Rimola Gibert, A. (Principal Investigator), Enrique Romero, J. (Researcher on contract), Martinez i Bachs, B. (Researcher on contract), Perrero ., J. (Researcher on contract), Peña Asensio, E. (Researcher on contract), Luque Urrutia, J. A. (Researcher on contract), Corno, M. (Others), Pareras Niell, G. (Researcher on contract), Kakkar , H. (Researcher on contract), Ferrero , S. (Investigator), Mates Torres, E. (Researcher on contract), Bancone , N. (Researcher on contract), Bariosco, V. (Collaborator), Ferrero, S. (Collaborator), Enrique-Romero, J. (Collaborator), Bulik , A. S. (Technician), Perotti, G. (Collaborator), Cecilia, C. (Collaborator), Jubert, L. (Collaborator), Bulik, A. S. (Collaborator), Lamberts, A. (Collaborator) & Alessandrini, S. (Collaborator)
1/09/20 → 31/12/25
Project: International research project
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ACO: AstroChemical Origins (ACO)
Martínez Bach, B. (Investigator), Ferrero , S. (Beneficiary), Rimola Gibert, A. (Principal Investigator) & Sodupe Roure, M. (Investigator)
1/05/19 → 31/10/23
Project: International research project
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Com podem revolucionar la captura del CO2? : Disseny computacional al rescat del clima
Pareras Niell, G., Taddei, M., Tiana, D. & Rimola Gibert, A., 2025, In: UAB Divulga. p. 0001-2 2 p.Translated title of the contribution :How can we revolutionize CO2 capture? :: Computational design to the rescue of the climate Research output: Contribution to journal › Article › Dissemination
Open Access -
Exploring Forsterite Surface Catalysis in HCN Polymerization : Computational Insights for Astrobiology and Prebiotic Chemistry
Bancone, N., Pantaleone, S., Ugliengo, P., Rimola Gibert, A. & Corno, M., 20 Feb 2025, In: ACS Earth and Space Chemistry. 9, 2, p. 303-313 11 p.Research output: Contribution to journal › Article › Research › peer-review
Open Access1 Citation (Web of Science) -
Binding energies of ethanol and ethylamine on interstellar water ices : synergy between theory and experiments
Perrero, J., Vitorino, J., Congiu, E., Ugliengo, P., Rimola Gibert, A. & Dulieu, F., 2024, In: Physical Chemistry Chemical Physics. 26, 26, p. 18205-18222 18 p.Research output: Contribution to journal › Article › Research › peer-review
Open Access1 Citation (Scopus) -
Binding Energies of N-bearing Species on Interstellar Water Ice Mantles by Quantum Chemical Calculations
Martínez-Bachs, B., Ceccarelli, C., Ugliengo, P. & Rimola, A., 2024, In: Astrophysical Journal. 969, 1Research output: Contribution to journal › Article › Research › peer-review
Open Access6 Citations (Scopus) -
Formation of Methanol via Fischer-Tropsch Catalysis by Cosmic Iron Sulphide
Martínez-Bachs, B., Anguera González, A., Pareras Niell, G. & Rimola Gibert, A., 2 Sept 2024, In: ChemPhysChem. 25, 17, 13 p., e202400272.Research output: Contribution to journal › Article › Research › peer-review
Open Access4 Citations (Web of Science)
Thesis
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Activation of Amino Acids and Peptides by interaction of Cu+ and Cu2+ cations and Aluminosilicate Surfaces
Rimola Gibert, A. (Author), Sodupe Roure, M. (Director) & Rodríguez Santiago, L. A. (Director), 8 Mar 2007Student thesis: Doctoral thesis
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Study on Pd(II) Complexes with Hybrid Hemilabile Pyrazole-Derivative ligands
Rimola Gibert, A. (Author), Pons Picart, J. (Director), Ros Badosa, J. (Director) & Sodupe Roure, M. (Director), 1 Dec 2003Student thesis: Final degree project (TFG)
Datasets
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Atomic coordinates of the structures of iCOMs adsorbed at the surface of an amorphous ice model
Ferrero, S. (Creator), Zamirri, L. (Creator), Ceccarelli, C. (Creator), Witzel, A. (Creator), Rimola, A. (Creator), Ugliengo, P. (Creator) & Ugliengo, P. (Contributor), Zenodo, 14 Apr 2021
DOI: 10.5281/zenodo.4603786, https://zenodo.org/record/4603786
Dataset
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Binding Energies of Interstellar Relevant S-bearing Species on Water Ice Mantles: A Quantum Mechanical Investigation
Perrero, J. (Creator), Enrique-Romero, J. (Creator), Ferrero, S. (Creator), Ceccarelli, C. (Creator), Podio, L. (Creator), Codella, C. (Creator), Rimola, A. (Creator) & Ugliengo, P. (Creator), Zenodo, 5 Jul 2022
DOI: 10.5281/zenodo.6798922, https://zenodo.org/record/6798922
Dataset
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XYZ files & Spin densities and Molecular Orbitals for "Quantum mechanical simulations of the radical-radical chemistry on icy surfaces"
Enrique-Romero, J. (Creator), Rimola, A. (Creator), Ceccarelli, C. (Creator), Ugliengo, P. (Creator), Balucani, N. (Creator), Skouteris, D. (Creator) & Enrique-Romero, J. (Contributor), Zenodo, 8 Dec 2021
DOI: 10.5281/zenodo.5723996, https://zenodo.org/record/5723996
Dataset
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Atomic coordinates of the periodic crystalline ice grain model
Ferrero , S. (Creator), Zamirri, L. (Creator), Ceccarelli, C. (Creator), Witzel, A. (Creator), Rimola, A. (Creator), Ugliengo, P. (Creator) & Ugliengo, P. (Contributor), Zenodo, 14 Apr 2021
DOI: 10.5281/zenodo.4603774, https://zenodo.org/record/4603774
Dataset
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Atomic coordinates of the structures of iCOMs adsorbed at the surface of a crystalline ice model
Ferrero , S. (Creator), Zamirri, L. (Creator), Ceccarelli, C. (Creator), Witzel, A. (Creator), Rimola, A. (Creator), Ugliengo, P. (Creator) & Ugliengo, P. (Contributor), Zenodo, 14 Apr 2021
DOI: 10.5281/zenodo.4603782, https://zenodo.org/record/4603782
Dataset