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Cristina Puzzarini

Professoressa ordinaria

Dipartimento di Chimica "Giacomo Ciamician"

Settore scientifico disciplinare: CHIM/02 CHIMICA FISICA

Pubblicazioni

Puzzarini, Cristina, Astronomical complex organic molecules: Quantum chemistry meets rotational spectroscopy, «INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY», 2017, 117, pp. 129 - 138 [articolo]

Linguerri, Roberto; Puzzarini, Cristina; Al Mogren, Muneerah Mogren; Francisco, Joseph S.; Hochlaf, Majdi, Benchmark study of the structural and spectroscopic parameters of the hydroxymethyl peroxy (HOCH2OO) radical and its decomposition reaction to HO2 and H2CO, «THE JOURNAL OF CHEMICAL PHYSICS», 2017, 146, pp. 144303/1 - 144303/13 [articolo]

Skouteris, D.; Vazart, F.; Ceccarelli, C.; Balucani, N.; Puzzarini, C.; and Barone, V., New quantum chemical computations of formamide deuteration support gas-phase formation of this prebiotic molecule, «MONTHLY NOTICES OF THE ROYAL ASTRONOMICAL SOCIETY», 2017, 468, pp. L1 - L5 [articolo]

Spada, Lorenzo; Tasinato, Nicola; Vazart, Fanny; Barone, Vincenzo; Caminati, Walther; Puzzarini, Cristina, Noncovalent Interactions and Internal Dynamics in Pyridine–Ammonia: A Combined Quantum-Chemical and Microwave Spectroscopy Study, «CHEMISTRY-A EUROPEAN JOURNAL», 2017, 23, pp. 4876 - 4883 [articolo]

Puzzarini, Cristina, Accurate molecular structures of small- and medium-sized molecules, «INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY», 2016, 116, pp. 1513 - 1519 [articolo]

Piccardo, Matteo; Penocchio, Emanuele; Puzzarini, Cristina; Biczysko, Malgorzata; Barone, Vincenzo, Erratum: Semi-Experimental Equilibrium Structure Determinations by Employing B3LYP/SNSD Anharmonic Force Fields: Validation and Application to Semirigid Organic Molecules(Journal of Physical Chemistry A (2015) 119 (2058-2082) 10.1021/jp511432m), «JOURNAL OF PHYSICAL CHEMISTRY. A, MOLECULES, SPECTROSCOPY, KINETICS, ENVIRONMENT, & GENERAL THEORY», 2016, 120, pp. 3754 - 3754 [articolo]

Cazzoli, Gabriele; Lattanzi, Valerio; Kirsch, Till; Gauss, Jurgen; Tercero, Belen; Cernicharo, Jose; Puzzarini, Cristina, Laboratory measurements and astronomical search for the HSO radical, «ASTRONOMY & ASTROPHYSICS», 2016, 591, pp. A126/1 - A126/7 [articolo]

Cacciani, Patrice; Cosléou, Jean; Khelkhal, Mohamed; Čermák, Peter; Puzzarini, Cristina, Nuclear Spin Conversion in CH4: A Multichannel Relaxation Mechanism, «JOURNAL OF PHYSICAL CHEMISTRY. A, MOLECULES, SPECTROSCOPY, KINETICS, ENVIRONMENT, & GENERAL THEORY», 2016, 120, pp. 173 - 182 [articolo]

Vazart, Fanny; Calderini, Danilo; Puzzarini, Cristina; Skouteris, Dimitrios; Barone, Vincenzo, State-of-the-Art Thermochemical and Kinetic Computations for Astrochemical Complex Organic Molecules: Formamide Formation in Cold Interstellar Clouds as a Case Study, «JOURNAL OF CHEMICAL THEORY AND COMPUTATION», 2016, 12, pp. 5385 - 5397 [articolo]

Alessandrini, Silvia; Puzzarini, Cristina, Structural and Energetic Characterization of Prebiotic Molecules: The Case Study of Formamide and Its Dimer, «JOURNAL OF PHYSICAL CHEMISTRY. A, MOLECULES, SPECTROSCOPY, KINETICS, ENVIRONMENT, & GENERAL THEORY», 2016, 120, pp. 5257 - 5263 [articolo]

Linguerri, Roberto; Puzzarini, Cristina; Francisco, Joseph S., Structure and spectroscopic properties of low-lying states of the HOC(O)O radical, «THE JOURNAL OF CHEMICAL PHYSICS», 2016, 144, pp. 084306-1 - 084306-7 [articolo]

Cazzoli, Gabriele; Kirsch, Till; Gauss, Jürgen; Puzzarini, Cristina, The rotational spectrum of 17O2 up to the THz region, «JOURNAL OF QUANTITATIVE SPECTROSCOPY & RADIATIVE TRANSFER», 2016, 168, pp. 10 - 16 [articolo]

Bellili, A.; Linguerri, R.; Hochlaf, M.; Puzzarini, C, Accurate structural and spectroscopic characterization of prebiotic molecules: The neutral and cationic acetyl cyanide and their related species, «THE JOURNAL OF CHEMICAL PHYSICS», 2015, 143, pp. 184314-1 - 184314-12 [articolo]

Barone, Vincenzo; Biczysko, Malgorzata; Bloino, Julien; Cimino, Paola; Penocchio, Emanuele; Puzzarini, Cristina, CC/DFT Route toward Accurate Structures and Spectroscopic Features for Observed and Elusive Conformers of Flexible Molecules: Pyruvic Acid as a Case Study, «JOURNAL OF CHEMICAL THEORY AND COMPUTATION», 2015, 11, pp. 4342 - 4363 [articolo]

Puzzarini, Cristina; Biczysko, Malgorzata, Computational Spectroscopy Tools for Molecular Structure Analysis, in: Structure Elucidation in Organic Chemistry: The Search for the Right Tools, Weinheim, Wiley Blackwell, 2015, pp. 27 - 64 [capitolo di libro]