Benmoussa, N. C.; Alessandrini, S.; De Boer, L.; Azizi, S.; Friha, H.; Bachir, R.; Hochlaf, M.; Puzzarini, C.; Linguerri, R., Computational Characterization of the Energetics, Structure, and Spectroscopy of Biofuel Precursors: The Case of Furfural-Acetone-Furfural, «JOURNAL OF COMPUTATIONAL CHEMISTRY», 2026, 47, pp. e70297/1 - e70297/12 [Scientific article]
Field-Theodore, T. E.; Ravasio, M.; Alessandrini, S.; Cavallotti, C.; Puzzarini, C., A Theoretical Investigation of OH• + H2CCNH Reactivity: Interstellar Insights into Glycolonitrile Formation, «THE ASTROPHYSICAL JOURNAL», 2025, 993, Article number: 179 , pp. 179/1 - 179/25 [Scientific article]
Savarese, A.; Alessandrini, S.; Melosso, M.; Panizzi, G.; Nonne, M.; Bizzocchi, L.; Puzzarini, C., Energetic and Spectroscopic Insights into the C3H6O2Isomer Family for Astrochemical Purposes, «ACS EARTH AND SPACE CHEMISTRY», 2025, 10, pp. 198 - 209 [Scientific article]Open Access
Field-Theodore, Terri E.; Alessandrini, Silvia; Melosso, Mattia; Puzzarini, Cristina, Extension of the Lego-brick approach to protonated molecules, «CHEMICAL PHYSICS LETTERS», 2025, 868, Article number: 141978 , pp. 1 - 11 [Scientific article]
Perrero, J.; Alessandrini, S.; Ye, H.; Puzzarini, C.; Rimola, A., Formation of the glycine isomer glycolamide (NH2C(O)CH2OH) on the surfaces of interstellar ice grains: Insights from atomistic simulations, «ASTRONOMY & ASTROPHYSICS», 2025, 698, Article number: A51 , pp. A51/1 - A51/15 [Scientific article]
Alessandrini, S.; Ye, H.; Puzzarini, C., Gas-Phase Reactions of H2CS and H2CO with CN: Similarities and Differences from a Computational Study, «ACS EARTH AND SPACE CHEMISTRY», 2025, 9, pp. 1217 - 1226 [Scientific article]
Comte, D.; Melosso, M.; Alessandrini, S.; Bizzocchi, L.; Rivilla, V. M.; Jiménez-Serra, I.; Puzzarini, C., Protonated phosphorus mononitride: Spectroscopic parameters and formation routes relevant for astrochemistry, «THE JOURNAL OF CHEMICAL PHYSICS», 2025, 163, Article number: 214306 , pp. 1 - 18 [Scientific article]
Puzzarini, Cristina; Alessandrini, Silvia, Carbamic acid and its dimer: A computational study, «JOURNAL OF COMPUTATIONAL CHEMISTRY», 2024, 45, pp. 2501 - 2512 [Scientific article]Open Access
Alessandrini, Silvia; Ye, Hexu; Biczysko, Malgorzata; Puzzarini, Cristina, Describing the Disulfide Bond: From the Density Functional Theory and Back through the “Lego Brick” Approach, «JOURNAL OF PHYSICAL CHEMISTRY. A, MOLECULES, SPECTROSCOPY, KINETICS, ENVIRONMENT, & GENERAL THEORY», 2024, 128, pp. 9383 - 9397 [Scientific article]Open Access
Puzzarini C.; Alessandrini S., Interstellar Ices: A Factory of the Origin-of-Life Molecules, «ACS CENTRAL SCIENCE», 2024, 10, pp. 13 - 15 [Scientific article]Open Access
Puzzarini, C.; Ye, H.; Alessandrini, S., Isomerism of CH2SO: Accurate structural, energetic, and spectroscopic characterization, «JOURNAL OF COMPUTATIONAL CHEMISTRY», 2024, 45, pp. 777 - 786 [Scientific article]Open Access
Bizzocchi, Luca; Tonolo, Francesca; Giuliano, Barbara M.; Caselli, Paola; Melosso, Mattia; Dore, Luca; Alessandrini, Silvia; Puzzarini, Cristina; Pietropolli Charmet, Andrea, Millimeter to THz Spectroscopy of HC18O+ and HC17O+: Accurate Rest Frequencies for Astrophysical Studies, «THE ASTROPHYSICAL JOURNAL», 2024, 970, Article number: 26 , pp. 1 - 8 [Scientific article]Open Access
Ye H.; Alessandrini S.; Puzzarini C., On the General Mechanism for the Gas-phase Reaction of Methanimine with a Radical Species in the Interstellar Medium: Some Failures and an Important Success, «THE ASTROPHYSICAL JOURNAL», 2024, 962, Article number: 31 , pp. 1 - 14 [Scientific article]Open Access
Alessandrini, Silvia; Melosso, Mattia; Bizzocchi, Luca; Barone, Vincenzo; Puzzarini, Cristina, The Semiexperimental Approach at Work: Equilibrium Structure of Radical Species, «JOURNAL OF PHYSICAL CHEMISTRY. A, MOLECULES, SPECTROSCOPY, KINETICS, ENVIRONMENT, & GENERAL THEORY», 2024, 128, pp. 5833 - 5855 [Scientific article]Open Access
Nonne, Michela; Melosso, Mattia; Tonolo, Francesca; Bizzocchi, Luca; Alessandrini, Silvia; Guillemin, Jean-Claude; Dore, Luca; Puzzarini, Cristina, Tracing Prebiotic Molecules: Rotational Spectroscopy of Deuterated Glycolaldehyde and (Z)-1,2-Ethenediol, «JOURNAL OF PHYSICAL CHEMISTRY. A, MOLECULES, SPECTROSCOPY, KINETICS, ENVIRONMENT, & GENERAL THEORY», 2024, 128, pp. 4850 - 4858 [Scientific article]Open Access
