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Cited article:

Reactive hydrogenation of interstellar carbon monoxide ices. The viewpoint of machine learning-driven simulations

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Monthly Notices of the Royal Astronomical Society 545 (4) (2026)
https://doi.org/10.1093/mnras/staf2114

Confined Chemistry in Space: Zeolite‐Supported Fe13 Nanoclusters Modulate CS Reactivity

Gerard Pareras and Albert Rimola
Small Structures 7 (3) (2026)
https://doi.org/10.1002/sstr.202500909

Atom Addition Formation of Thionylimide (HNSO) on Interstellar Dust Grains: Chemical Routes Requiring Oxygen and Nitrogen Atom Surface Diffusion

Juan Carlos del Valle, Miguel Sanz-Novo, Johannes Kästner, Kenji Furuya, Víctor M. Rivilla, Rafael Martín-Doménech and Germán Molpeceres
ACS Earth and Space Chemistry (2026)
https://doi.org/10.1021/acsearthspacechem.5c00360

A sensitivity analysis of interstellar ice chemistry in astrochemical models

Tobias M. Dijkhuis, Thanja Lamberts, Serena Viti and Herma M. Cuppen
Astronomy & Astrophysics 706 A172 (2026)
https://doi.org/10.1051/0004-6361/202557925

Formic acid isomerism in dark clouds

G. Molpeceres, M. Agúndez, M. Mallo, C. Cabezas, M. Sanz-Novo, V. M. Rivilla, J. García de la Concepción, I. Jiménez-Serra and J. Cernicharo
Astronomy & Astrophysics 703 A164 (2025)
https://doi.org/10.1051/0004-6361/202555969

Diffusive versus non-diffusive paths to interstellar hydrogen peroxide

J. Poštulka, P. Slavíček, J. Kästner and G. Molpeceres
Astronomy & Astrophysics 697 A51 (2025)
https://doi.org/10.1051/0004-6361/202452617

Emergence of accurate atomic energies from machine-learned noble-gas potentials

Frank Uhlig, Samuel Tovey and Christian Holm
The Journal of Chemical Physics 162 (18) (2025)
https://doi.org/10.1063/5.0227640

Comprehensive Atomistic Simulations of Fischer–Tropsch in Outer Space: Astrocatalysis by Fe13–Supported Nanoclusters on SiO2

Gerard Pareras, Victoria Cabedo, Martin McCoustra and Albert Rimola
The Journal of Physical Chemistry C 129 (22) 10069 (2025)
https://doi.org/10.1021/acs.jpcc.5c01472

Single-atom iron on silicon carbide surfaces as catalyst of Fischer-Tropsch-type reactions in astrophysical environments

Gerard Pareras and Albert Rimola
Frontiers in Astronomy and Space Sciences 12 (2025)
https://doi.org/10.3389/fspas.2025.1605553

Energy partitioning in H2 formation on interstellar carbonaceous grains. Insights from ab initio molecular dynamics simulations

Léana Jubert, Berta Martínez-Bachs, Gerard Pareras and Albert Rimola
Physical Chemistry Chemical Physics 27 (29) 15385 (2025)
https://doi.org/10.1039/D5CP01585E

Quantum mechanical investigation on the formation of silicate building blocks on interstellar ice mantles

A Gelli, J Perrero, S Ferrero, J Enrique-Romero, C Ceccarelli, P Ugliengo, N Balucani and A Rimola
Monthly Notices of the Royal Astronomical Society 541 (4) 3963 (2025)
https://doi.org/10.1093/mnras/staf1191

Formation of Unsaturated Carbon Chains through Carbon Chemisorption on Solid CO

Masashi Tsuge, Germán Molpeceres, Ryota Ichimura, Hideko Nomura, Kenji Furuya and Naoki Watanabe
The Astrophysical Journal 993 (2) 177 (2025)
https://doi.org/10.3847/1538-4357/ae0a50

Binding Energies of Interstellar Complex Organic Molecules on Water Ice Surfaces: A Quantum Chemical Investigation

Harjasnoor Kakkar, Berta Martínez-Bachs, Cecilia Ceccarelli, Piero Ugliengo and Albert Rimola
The Astrophysical Journal 993 (2) 184 (2025)
https://doi.org/10.3847/1538-4357/ae064a

CO adsorption sites on interstellar water ices explored with machine learning potentials

G. M. Bovolenta, G. Molpeceres, K. Furuya, J. Kästner and S. Vogt-Geisse
Astronomy & Astrophysics 703 A172 (2025)
https://doi.org/10.1051/0004-6361/202555836

Formation of the Interstellar Sugar Precursor, (Z)-1,2-Ethenediol, through Radical Reactions on Dust Grains

Juan Carlos del Valle, Pilar Redondo, Johannes Kästner and Germán Molpeceres
The Astrophysical Journal 974 (1) 129 (2024)
https://doi.org/10.3847/1538-4357/ad6f9a

Proposed Importance of HOCO Chemistry: Inefficient Formation of CO2 from CO and OH Reactions on Ice Dust

Atsuki Ishibashi, Germán Molpeceres, Hiroshi Hidaka, Yasuhiro Oba, Thanja Lamberts and Naoki Watanabe
The Astrophysical Journal 976 (2) 162 (2024)
https://doi.org/10.3847/1538-4357/ad8235

Formation of Interstellar Complex Organic Molecules on Water-rich Ices Triggered by Atomic Carbon Freezing

Stefano Ferrero, Cecilia Ceccarelli, Piero Ugliengo, Mariona Sodupe and Albert Rimola
The Astrophysical Journal 960 (1) 22 (2024)
https://doi.org/10.3847/1538-4357/ad0547

A multi-grain multi-layer astrochemical model with variable desorption energy for surface species

Juris Kalvāns, Aija Kalniņa and Kristaps Veitners
Astronomy & Astrophysics 687 A296 (2024)
https://doi.org/10.1051/0004-6361/202450015

Carbon Atom Condensation on NH3–H2O Ices. An Alternative Pathway to Interstellar Methanimine and Methylamine

Germán Molpeceres, Masashi Tsuge, Kenji Furuya, Naoki Watanabe, David San Andrés, Víctor M. Rivilla, Laura Colzi and Yuri Aikawa
The Journal of Physical Chemistry A 128 (19) 3874 (2024)
https://doi.org/10.1021/acs.jpca.3c08286

Quantum mechanical modelling of the grain-surface formation of acetaldehyde on H2O:CO dirty ice surfaces

Jessica Perrero, Piero Ugliengo, Cecilia Ceccarelli and Albert Rimola
Monthly Notices of the Royal Astronomical Society 525 (2) 2654 (2023)
https://doi.org/10.1093/mnras/stad2459