Pubblicazioni del ROT&Comp Lab
C. Puzzarini, Ab initio characterization of XH3 (X=N,P). I. Ammonia, phosphine, and their related ions and radicals: structure and thermochemistry, «THEORETICAL CHEMISTRY ACCOUNTS», 2008, 120, pp. 325 - 336 [Articolo in rivista]
C. Puzzarini, Ab initio characterization of XH3 (X=N,P). II. Electric, magnetic and spectroscopic properties of ammonia and phosphine, «THEORETICAL CHEMISTRY ACCOUNTS», 2008, 121, pp. 1 - 10 [Articolo in rivista]
G. Cazzoli; C. Puzzarini, Lamb-dip spectrum of methylacetylene and methyldiacetylene: precise rotational transition frequencies and parameters of the main isotopic species, «ASTRONOMY & ASTROPHYSICS», 2008, 487, pp. 1197 - 1202 [Articolo in rivista]
C. Puzzarini; V. Barone, A critical analysis of the structure and vibrational frequencies of F2NO+ and Cl2NO+ from accurate quantum chemical computations, «CHEMICAL PHYSICS LETTERS», 2008, 462, pp. 49 - 52 [Articolo in rivista]
C. Puzzarini; V. Barone, Toward spectroscopic accuracy for organic free radicals: molecular structure, vibrational spectrum and magnetic properties of F2NO, «THE JOURNAL OF CHEMICAL PHYSICS», 2008, 129, pp. 084306-1 - 084306-7 [Articolo in rivista]
G. Cazzoli; L. Cludi; M. Contento; C. Puzzarini, Rotational spectrum of CH3C(13)CCCH: determination of the equilibrium structure of methyldiacetylene from microwave spectroscopy and ab initio calculations, «JOURNAL OF MOLECULAR SPECTROSCOPY», 2008, 251, pp. 229 - 234 [Articolo in rivista]
F. Rohart; J.-M. Colmont; G. Wlodarczak; G. Cazzoli; L. Dore; C. Puzzarini, Galatry versus Speed Dependent Voigt Profiles for Millimeter Lines of O3 in Collision with N2 and O2, «JOURNAL OF MOLECULAR SPECTROSCOPY», 2008, 251, pp. 282 - 292 [Articolo in rivista]
G. Cazzoli; C. Puzzarini; S. Stopkowicz; J. Gauss, The hyperfine structure in the rotational spectra of bromofluoromethane isotopologues: Lamb-dip technique and quantum-chemical calculations, «MOLECULAR PHYSICS», 2008, 106, pp. 1181 - 1192 [Articolo in rivista]
G. Cazzoli; C. Puzzarini, The Lamb-dip spectrum of methylcyanide. Precise rotational transition frequencies and improved ground-state rotational parameters. [Erratum], «JOURNAL OF MOLECULAR SPECTROSCOPY», 2008, 247, pp. 187 - 188 [Articolo in rivista]
C. Degli Esposti; L. Bizzocchi., The radiative decay of green and red photoluminescent phosphors: an undergraduate kinetics experiment for Materials Chemistry., «JOURNAL OF CHEMICAL EDUCATION», 2008, 85, pp. 839 - 841 [Articolo in rivista]
L. Bizzocchi; C. Degli Esposti, Millimetre-wave spectroscopy of HC4Cl in ground and excited vibrational states., «CHEMICAL PHYSICS», 2008, 346, pp. 139 - 145 [Articolo in rivista]
L. Bizzocchi; C. Degli Esposti; L. Dore; Z. Kisiel, Submillimetre-wave spectrum, 14N-hyperfine structure, and dipole moment of cyclopropyl cyanide, «JOURNAL OF MOLECULAR SPECTROSCOPY», 2008, 251, pp. 138 - 144 [Articolo in rivista]
L. Dore; L. Bizzocchi; C. Degli Esposti, The millimeter-wave spectrum of SH2D+: Determination of the harmonic force field of the sulfonium ion, in: Scientific contribution, s.l, s.n, 2008, pp. P-17 - P-17 (atti di: Latsis-Symposium "Intramolecular Dynamics, Symmetry and Spectroscopy", ETH Zurich, Switzerland, September 6-10, 2008) [Riassunto (Abstract)]
G. Cazzoli; C. Puzzarini; G. Buffa; O. Tarrini, Pressure-broadening of water lines in the THz frequency region: Improvements and confirmations for spectroscopic databases. Part I, «JOURNAL OF QUANTITATIVE SPECTROSCOPY & RADIATIVE TRANSFER», 2008, 109, pp. 2820 - 2831 [Articolo in rivista]
C. Puzzarini, High resolution rotational spectroscopy as a source of information on the structure and magneto-electric properties of molecules, in: Twenty-second Austin Symposium on Molecular Structure, AUSTIN (TEXAS), s.n, 2008, pp. 50 - 50 (atti di: 22nd Austin Symposium on Molecular Structure, Austin, Texas (USA), 1-4 Marzo 2008) [Contributo in Atti di convegno]
G. Cazzoli; C. Puzzarini; G. Buffa, Pressure-broadening of water lines in the THz frequency region: improvements and confirmations for spectroscopic databases, in: HITRAN. The 10th HITRAN Database Conference, CAMBRIDGE, MA, s.n, 2008, pp. 71 - 72 (atti di: The 10th HITRAN Database Conference, Cambridge, MA (USA) - Harvard-Smithsonian Ceneter for Astrophysics, 22-24 Giugno 2008) [Riassunto (Abstract)]
C. Puzzarini, Benchmark calculations for molecules in the gas phase: state-of-the-art coupled-cluster computations, in: CHITEL 08. XXXIV Congresso dei Chimici Teorici di Esperessione Latina, s.l, s.n, 2008, pp. 62 - 62 (atti di: CHITEL 08, Cetraro (CS), Italia, 3-8 Luglio 2008) [Contributo in Atti di convegno]
C. Puzzarini; V. Barone, Benchmark calculations on nucleobases: uracil as a test case, in: XXXVII Congresso Nazionale di Chimica Fisica. Chimica fisica, crocevia della scienza., GENOVA, s.n, 2008, pp. 47 - 47 (atti di: XXXVII Congresso Nazionale di Chimica Fisica, Camogli (GE), Italia, 24-29 Febbraio 2008) [Contributo in Atti di convegno]
G. Cazzoli; C. Puzzarini; G. Buffa; O. Tarrini, Pressure-broadening of water lines in the THz frequency region: improvements and confirmations for spectroscopic database, in: The 20th International Conference on High Resolution Molecular Spectroscopy, PRAGA, ICT Press, 2008, pp. 257 - 257 (atti di: The 20th International Conference on High Resolution Molecular Spectroscopy, PRAGA, Repubblica Ceca, 2-6 Settembre 2008) [Contributo in Atti di convegno]
C. Puzzarini; V. Barone, Toward spectroscopic accuracy for open-shell systems: X2AB radicals as test cases, in: CC7. 7th European Conference on Computationla Chemistry. Book of abstracts, VENEZIA, s.n, 2008, pp. 52 - 53 (atti di: CC7. 7th European Conference on Computationla Chemistry., S. Servolo, VE. Italia, 11-15 Settembre 2008) [Contributo in Atti di convegno]