Pubblicazioni del ROT&Comp Lab
Alessandrini, S.; Melosso, M.; Jiang, N.; Bizzocchi, L.; Dore, L.; Puzzarini, C., Conformational stability of cyclopropanecarboxaldehyde is ruled by vibrational effects, «MOLECULAR PHYSICS», 2021, 119, pp. 1 - 13 [Articolo in rivista] Open Access
Melosso M.; Diouf M.L.; Bizzocchi L.; Harding M.E.; Cozijn F.M.J.; Puzzarini C.; Ubachs W., Hyperfine-Resolved Near-Infrared Spectra of H217O, «JOURNAL OF PHYSICAL CHEMISTRY. A, MOLECULES, SPECTROSCOPY, KINETICS, ENVIRONMENT, & GENERAL THEORY», 2021, 125, pp. 7884 - 7890 [Articolo in rivista] Open Access
Lupi J.; Alessandrini S.; Puzzarini C.; Barone V., JunChS and junChS-F12 Models: Parameter-free Efficient yet Accurate Composite Schemes for Energies and Structures of Noncovalent Complexes, «JOURNAL OF CHEMICAL THEORY AND COMPUTATION», 2021, 17, pp. 6974 - 6992 [Articolo in rivista] Open Access
Garcia De La Concepcion J.; Puzzarini C.; Barone V.; Jimenez-Serra I.; Roncero O., Formation of Phosphorus Monoxide (PO) in the Interstellar Medium: Insights from Quantum-chemical and Kinetic Calculations, «THE ASTROPHYSICAL JOURNAL», 2021, 922, pp. 1 - 2 [Articolo in rivista] Open Access
Sheng, M.; Silvestrini, F.; Biczysko, M.; Puzzarini, C., Structural and Vibrational Properties of Amino Acids from Composite Schemes and Double-Hybrid DFT: Hydrogen Bonding in Serine as a Test Case, «JOURNAL OF PHYSICAL CHEMISTRY. A, MOLECULES, SPECTROSCOPY, KINETICS, ENVIRONMENT, & GENERAL THEORY», 2021, 125, pp. 9099 - 9114 [Articolo in rivista] Open Access
Melli A.; Tonolo F.; Barone V.; Puzzarini C., Extending the Applicability of the Semi-experimental Approach by Means of "template Molecule" and "linear Regression" Models on Top of DFT Computations, «JOURNAL OF PHYSICAL CHEMISTRY. A, MOLECULES, SPECTROSCOPY, KINETICS, ENVIRONMENT, & GENERAL THEORY», 2021, 125, pp. 9904 - 9916 [Articolo in rivista] Open Access
Tonolo F.; Bizzocchi L.; Melosso M.; Lique F.; Dore L.; Barone V.; Puzzarini C., An improved study of HCO+ and He system: Interaction potential, collisional relaxation, and pressure broadening, «THE JOURNAL OF CHEMICAL PHYSICS», 2021, 155, pp. 1 - 9 [Articolo in rivista] Open Access
Puzzarini C.; Barone V., CHAPTER 10: Interstellar Complex Organic Molecules: A Step Toward Biomolecule Building Blocks in the Skies, in: Prebiotic Photochemistry, Cambridge, UK, Royal Society of Chemsitry, 2021, pp. 195 - 218 [Capitolo/Saggio in libro]
Arenas, B. E.; Batra, G.; Steber, A. L.; Bizzocchi, L.; Pietropolli Charmet, A.; Giuliano, B. M.; Caselli, P.; Harris, B. J.; Pate, B. H.; Guillemin, J. -C.; Schnell, M., Rotational spectroscopy of imidazole: Accurate spectroscopic information for three vibrationally excited states and the heavy-atom isotopologues up to 295 GHz, «JOURNAL OF MOLECULAR SPECTROSCOPY», 2021, 378, pp. 111452 - 111464 [Articolo in rivista] Open Access
Li, Xiaolong; Spada, Lorenzo; Alessandrini, Silvia; Zheng, Yang; Lengsfeld, Kevin Gregor; Grabow, Jens‐Uwe; Feng, Gang; Puzzarini, Cristina; Barone, Vincenzo, Gestapelt, nicht geklebt: Enthüllung der π→π*‐Wechselwirkung mithilfe des Benzofuran‐Formaldehyd‐Komplexes, «ANGEWANDTE CHEMIE», 2021, 134, pp. 1 - 7 [Articolo in rivista] Open Access
L. F. Rodríguez-Almeida; V. M. Rivilla; I. Jiménez-Serra; M. Melosso; L. Colzi; S. Zeng; B. Tercero; P. de Vicente; S. Martín; M. A. Requena-Torres; F. Rico-Villas; J. Martín-Pintado, First detection of C 2 H 5 NCO in the ISM and search of other isocyanates towards the G+0.693-0.027 molecular cloud, «ASTRONOMY & ASTROPHYSICS», 2021, 654, pp. 1 - 9 [Articolo in rivista]
Alessandrini, S; Melosso, M, Fate of the Gas-Phase Reaction Between Oxirane and the CN Radical in Interstellar Conditions, «FRONTIERS IN ASTRONOMY AND SPACE SCIENCES», 2021, 8, pp. 1 - 7 [Articolo in rivista] Open Access
Colzi, L.; Rivilla, V. M.; Beltrán, M. T.; Jiménez-Serra, I.; Mininni, C.; Melosso, M.; Cesaroni, R.; Fontani, F.; Lorenzani, A.; Sánchez-Monge, A.; Viti, S.; Schilke, P.; Testi, L.; Alonso, E. R.; Kolesniková, L., The GUAPOS project II. A comprehensive study of peptide-like bond molecules, «ASTRONOMY & ASTROPHYSICS», 2021, 653, pp. 1 - 45 [Articolo in rivista] Open Access
Chitarra, O; Lee, KLK; Buchanan, Z; Melosso, M; McGuire, BA; Goubet, M; Pirali, O; Martin-Drumel, MA, Hunting the relatives of benzonitrile: Rotational spectroscopy of dicyanobenzenes, «ASTRONOMY & ASTROPHYSICS», 2021, 652, pp. 1 - 8 [Articolo in rivista] Open Access
Puzzarini C.; Barone V., Chemical Evolution in Space: The Case of Imines, in: Memorie della Societa Astronomica Italiana - Journal of the Italian Astronomical Society, Societa Astronomica Italiana, 2021, 92, pp. 78 - 81 (atti di: 2020 1st Italian Space Agency Workshop on Astrobiology: The Italian Roadmap for the Next Decade, Italian Space Agency, ita, 2020) [Contributo in Atti di convegno]
Degli Esposti, C.; Melosso, M.; Bizzocchi, L.; Tamassia, F.; Dore, L., Determination of a semi-experimental equilibrium structure of 1-phosphapropyne from millimeter-wave spectroscopy of CH3CP and CD3CP, «JOURNAL OF MOLECULAR STRUCTURE», 2020, 1203, pp. 1 - 9 [Articolo in rivista] Open Access
Melosso M.; Dore L.; Tamassia F.; Brogan C.L.; Hunter T.R.; McGuire B.A., The Submillimeter Rotational Spectrum of Ethylene Glycol up to 890 GHz and Application to ALMA Band 10 Spectral Line Data of NGC 6334I, «JOURNAL OF PHYSICAL CHEMISTRY. A, MOLECULES, SPECTROSCOPY, KINETICS, ENVIRONMENT, & GENERAL THEORY», 2020, 124, pp. 240 - 246 [Articolo in rivista] Open Access
Alessandrini S.; Barone V.; Puzzarini C., Extension of the "cheap" Composite Approach to Noncovalent Interactions: The jun-ChS Scheme, «JOURNAL OF CHEMICAL THEORY AND COMPUTATION», 2020, 16, pp. 988 - 1006 [Articolo in rivista] Open Access
Bizzocchi L.; Melosso M.; Giuliano B.M.; Dore L.; Tamassia F.; Martin-Drumel M.-A.; Pirali O.; Pirali O.; Margules L.; Caselli P., Submillimeter and Far-infrared Spectroscopy of Monodeuterated Amidogen Radical (NHD): Improved Rest Frequencies for Astrophysical Observations, «ASTROPHYSICAL JOURNAL SUPPLEMENT SERIES», 2020, 247, pp. 1 - 8 [Articolo in rivista] Open Access
Melosso, M.; Bizzocchi, L.; Sipila, O.; Giuliano, B. M.; Dore, L.; Tamassia, F.; Martin-Drumel, M. -A.; Pirali, O.; Redaelli, E.; Caselli, P., First detection of NHD and ND2in the interstellar medium: Amidogen deuteration in IRAS 16293-2422, «ASTRONOMY & ASTROPHYSICS», 2020, 641, pp. 1 - 10 [Articolo in rivista] Open Access