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 [articolo]
Puzzarini, Cristina; Alessandrini, Silvia, Carbamic acid and its dimer: A computational study, «JOURNAL OF COMPUTATIONAL CHEMISTRY», 2024, 45, pp. 2501 - 2512 [articolo]
Tonolo, F; Bizzocchi, L; Rivilla, V M; Lique, F; Melosso, M; Puzzarini, C, Collisional excitation of PO+ by para-H2: potential energy surface, scattering calculations, and astrophysical applications, «MONTHLY NOTICES OF THE ROYAL ASTRONOMICAL SOCIETY», 2024, 527, pp. 2279 - 2287 [articolo]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 [articolo]
Puzzarini C.; Alessandrini S., Interstellar Ices: A Factory of the Origin-of-Life Molecules, «ACS CENTRAL SCIENCE», 2024, 10, pp. 13 - 15 [articolo]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 [articolo]
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 [articolo]
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 [articolo]Open Access
García de la Concepción, Juan; Cavallotti, Carlo; Barone, Vincenzo; Puzzarini, Cristina; Jiménez-Serra, Izaskun, Relevance of the P+O2 Reaction for PO Formation in Astrochemical Environments: Electronic Structure Calculations and Kinetic Simulations, «THE ASTROPHYSICAL JOURNAL», 2024, 963, pp. 142/1 - 142/12 [articolo]
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 [articolo]
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 [articolo]
Spaniol J.-T.; Lee K.L.K.; Pirali O.; Puzzarini C.; Martin-Drumel M.-A., A rotational investigation of the three isomeric forms of cyanoethynylbenzene (HCC-C6H4-CN): benchmarking experiments and calculations using the “Lego brick” approach, «PHYSICAL CHEMISTRY CHEMICAL PHYSICS», 2023, 25, pp. 6397 - 6405 [articolo]Open Access
Barone V.; Fusè M.; Aguado R.; Potenti S.; León I.; Alonso E.R.; Mata S.; Lazzari F.; Mancini G.; Spada L.; Gualandi A.; Cozzi P.G.; Puzzarini C.; Alonso J.L., Bringing Machine-Learning Enhanced Quantum Chemistry and Microwave Spectroscopy to Conformational Landscape Exploration: the Paradigmatic Case of 4-Fluoro-Threonine, «CHEMISTRY-A EUROPEAN JOURNAL», 2023, 29, Article number: e202203990, pp. 1 - 12 [articolo]Open Access
Alessandrini, Silvia; Melosso, Mattia; Rivilla, Víctor M.; Bizzocchi, Luca; Puzzarini, Cristina, Computational Protocol for the Identification of Candidates for Radioastronomical Detection and Its Application to the C3H3NO Family of Isomers, «MOLECULES», 2023, 28, Article number: 3226, pp. 1 - 18 [articolo]Open Access
Pietropolli Charmet, Andrea; Stoppa, Paolo; De Lorenzi, Alessandra; Melosso, Mattia; Achilli, Andrè; Dore, Luca; Puzzarini, Cristina; Cane', Elisabetta; Tamassia, Filippo, Computational, rotational and ro-vibrational experimental investigation of monodeuterated chloromethane, «JOURNAL OF QUANTITATIVE SPECTROSCOPY & RADIATIVE TRANSFER», 2023, 305, Article number: 108624, pp. 1 - 11 [articolo]Open Access
