Personal profile
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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Atomistic Modelling of the Chemical Properties of Interstellar Dust Grains
Rimola Gibert, A. (Principal Investigator), Bariosco , V. (Collaborator), Gelli , A. (Collaborator), Jubert , L. E. (Collaborator), Kyriazis , A. (Collaborator) & Pareras Niell, G. (Collaborator)
1/09/25 → 31/08/29
Project: Research Projects and Other Grants
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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), Jubert , L. E. (Collaborator), Bulik , A. S. (Collaborator) & Kyriazis , A. (Collaborator)
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)
European Regional Development Fund (FEDER)
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)
European Commission (EC), ERC Consolidator Grant
1/09/20 → 31/12/25
Project: International research project
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Confined Chemistry in Space : Zeolite-Supported Fe13 Nanoclusters Modulate CS Reactivity
Pareras Niell, G. & Rimola, A., Mar 2026, In: Small structures. 7, 3, e202500909.Research output: Contribution to journal › Article › Research › peer-review
Open Access -
FAUST-XXIX. OCS line emission : a new method for measuring the luminosity of embedded protostars in binary systems
Saury, G., Bariosco, V., Ceccarelli, C., López-Sepulcre, A., Chahine, L., De Simone, M., Rimola Gibert, A., Ugliengo, P., Chandler, C. J., Sakai, N., Codella, C., Bianchi, E., Boitard-Crépeau, L., Bouvier, M., Le Gal, R., Loinard, L., Oya, Y., Podio, L., Sabatini, G. & Vastel, C. & 2 others, , Jan 2026, In: Monthly Notices of the Royal Astronomical Society. 545, 3, 17 p.Research output: Contribution to journal › Article › Research › peer-review
Open Access -
Low-energy glycine formation and spectral masking in star-forming regions
Rimola Gibert, A. & Mates-Torres, E., 6 Jan 2026, In: Communications Chemistry. 9, 8 p., 68.Research output: Contribution to journal › Article › Research › peer-review
Open Access -
A Fully ab Initio Kinetic Monte Carlo Approach for Modeling Adsorption and Diffusion in Interstellar Icy Grain Mantles: The Case of H2S
Bariosco, V., Ceccarelli, C. & Rimola Gibert, A., 2025, In: ACS Earth and Space Chemistry. 10, 1, p. 66-79 14 p.Research output: Contribution to journal › Article › Research › peer-review
Open Access -
Atomistic Modeling of Methyl Formate and Glycolaldehyde Formation on Interstellar Dirty Ice Mantles via a "Radical + Ice" Mechanism
Perrero, J., Ugliengo, P. & Rimola Gibert, A., 10 Nov 2025, In: ChemPlusChem. 90, 11, 13 p., e202500324.Research output: Contribution to journal › Article › Research › peer-review
Open Access
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 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
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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