Sfoglia per Autore
Diving for Accurate Structures in the Ocean of Molecular Systems with the Help of Spectroscopy and Quantum Chemistry
2018 Puzzarini, Cristina; Barone, Vincenzo
Computational challenges in Astrochemistry
2018 Biczysko, Malgorzata; Bloino, Julien; Puzzarini, Cristina
Rotational and Infrared Spectroscopy of Ethanimine: A Route toward Its Astrophysical and Planetary Detection
2018 Melli, Alessio; Melosso, Mattia; Tasinato, Nicola; Bosi, Giulio; Spada, Lorenzo; Bloino, Julien; Mendolicchio, Marco; Dore, Luca; Barone, Vincenzo; Puzzarini, Cristina
Accurate rest frequencies for propargylamine in the ground and low-lying vibrational states
2018 Degli Esposti, C.; Dore, L.; Puzzarini, C.; Biczysko, M.; Bloino, J.; Bizzocchi, L.; Lattanzi, V.; Grabow, J. -U.
The Genealogical Tree of Ethanol: Gas-phase Formation of Glycolaldehyde, Acetic Acid, and Formic Acid
2018 Skouteris, Dimitrios; Balucani, Nadia; Ceccarelli, Cecilia; Vazart, Fanny; Puzzarini, Cristina; Barone, Vincenzo; Codella, Claudio; Lefloch, Bertrand
Laboratory measurements and astronomical search for cyanomethanimine
2018 Melosso, M.; Melli, A.; Puzzarini, C.; Codella, Claudio; Spada, L.; Dore, L.; Degli Esposti, C.; Lefloch, B.; Bachiller, R.; Ceccarelli, C.; Cernicharo, J.; Barone, V.
Unveiling the Sulfur-Sulfur Bridge: Accurate Structural and Energetic Characterization of a Homochalcogen Intermolecular Bond
2018 Obenchain, Daniel A.; Spada, Lorenzo; Alessandrini, Silvia; Rampino, Sergio; Herbers, Sven; Tasinato, Nicola; Mendolicchio, Marco; Kraus, Peter; Gauss, Jürgen; Puzzarini, Cristina; Grabow, Jens-Uwe; Barone, Vincenzo
Accuracy and Interpretability: The Devil and the Holy Grail. New Routes across Old Boundaries in Computational Spectroscopy
2019 Puzzarini, C.; Bloino, J.; Tasinato, N.; Barone, V.
A never-ending story in the sky: The secrets of chemical evolution
2019 Puzzarini, C.; Barone, V.
The Unexplored World of Cycloalkene–Water Complexes: Primary and Assisting Interactions Unraveled by Experimental and Computational Spectroscopy
2019 Wang, J.; Spada, L.; Chen, J.; Gao, S.; Alessandrini, S.; Feng, G.; Puzzarini, C.; Gou, Q.; Grabow, J. -U.; Barone, V.
State-of-the-art computation of the rotational and IR spectra of the methyl-cyclopropyl cation: Hints on its detection in space
2019 Puzzarini, Cristina; Tasinato, Nicola; Bloino, Julien; Spada, Lorenzo; Barone, Vincenzo
Theory meets experiment for elucidating the structure and stability of non-covalent complexes: Water-Amine interaction as a proof of concept
2020 Chen, Junhua; Zheng, Yang; Melli, Alessio; Spada, Lorenzo; Lu, Tao; Feng, Gang; Gou, Qian; Barone, Vincenzo; Puzzarini, Cristina
A Journey from Thermally Tunable Synthesis to Spectroscopy of Phenylmethanimine in Gas Phase and Solution
2020 Melli, Alessio; Potenti, Simone; Melosso, Mattia; Herbers, Sven; Spada, Lorenzo; Gualandi, Andrea; Lengsfeld, Kevin G.; Dore, Luca; Buschmann, Philipp; Cozzi, Pier Giorgio; Grabow, Jens-Uwe; Barone, Vincenzo; Puzzarini, Cristina
Erratum: The Italian national project of astrobiology-life in space-origin, presence, persistence of life in space, from molecules to extremophiles (Astrobiology (2020) 20:5 (580-582) DOI: 10.1089/ast.2020.2247)
2020 Onofri, S.; Balucani, N.; Barone, V.; Benedetti, P.; Billi, D.; Balbi, A.; Brucato, J. R.; Cobucci-Ponzano, B.; Costanzo, G.; Rocca, N. L.; Moracci, M.; Saladino, R.; Vladilo, G.; Albertini, N.; Battistuzzi, M.; Bloino, J.; Botta, L.; Casavecchia, P.; Cassaro, A.; Claudi, R.; Cocola, L.; Coduti, A.; Di Donato, P.; Di Mauro, E.; Dore, L.; Falcinelli, S.; Fulle, M.; Ivanovski, S.; Lombardi, A.; Mancini, G.; Maris, M.; Maurelli, L.; Murante, G.; Negri, R.; Pacelli, C.; Pagano, I.; Piccinino, D.; Poletto, L.; Prantera, G.; Puzzarini, C.; Rampino, S.; Ripa, C.; Rosi, M.; Sanna, M.; Selbmann, L.; Silva, L.; Skouteris, D.; Strazzulli, A.; Tasinato, N.; Timperio, A. M.; Tozzi, A.; Tozzi, G. P.; Trainotti, L.; Ugliengo, P.; Vaccaro, L.; Zucconi, L.
A twist on the reaction of the CN radical with methylamine in the interstellar medium: New hints from a state-of-the-art quantum-chemical study
2020 Puzzarini, C.; Salta, Z.; Tasinato, N.; Lupi, J.; Cavallotti, C.; Barone, V.
Methanimine as a Key Precursor of Imines in the Interstellar Medium: The Case of Propargylimine
2020 Lupi, Jacopo; Puzzarini, Cristina; Barone, Vincenzo
The Quest for a Plausible Formation Route of Formyl Cyanide in the Interstellar Medium: A State-of-the-art Quantum-chemical and Kinetic Approach
2020 Tonolo, Francesca; Lupi, Jacopo; Puzzarini, Cristina; Barone, Vincenzo
Exploring the Maze of C2N2H5 Radicals and Their Fragments in the Interstellar Medium with the Help of Quantum-Chemical Computations
2020 Salta, Zoi; Tasinato, Nicola; Lupi, Jacopo; Boussessi, Rahma; Balbi, Alice; Puzzarini, Cristina; Barone, Vincenzo
Systematic Study on the Absorption Features of Interstellar Ices in the Presence of Impurities
2020 Gorai, P.; Sil, M.; Das, A.; Sivaraman, B.; Chakrabarti, S. K.; Ioppolo, S.; Puzzarini, C.; Kanuchova, Z.; Dawes, A.; Mendolicchio, M.; Mancini, G.; Barone, V.; Nakatani, N.; Shimonishi, T.; Mason, N.
Rich Collection of n-Propylamine and Isopropylamine Conformers: Rotational Fingerprints and State-of-the-Art Quantum Chemical Investigation
2020 Melosso, Mattia; Melli, Alessio; Spada, Lorenzo.; Zheng, Yang; Chen, Junhua; Li, Meng; Lu, Tao; Feng, Gang; Gou, Qian; Dore, Luca; Barone, Vincenzo; Puzzarini, Cristina
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