Pubblicazioni del ROT&Comp Lab
C. Puzzarini, How accurately can structural, spectroscopic and thermochemical properties be predicted by ab initio computations?, in: Lecture series on Computer and Computational Sciences - Trends and perspectives in modern computational science, LEIDEN, Brill Academic Publishers, 2006, 6, pp. 416 - 425 (atti di: International Conference of Computational Methods in Sciences and Engineering 2006 (ICCMSE 2006), Chania, Crete, Greece, 27/10-1/11 2006) [Contributo in Atti di convegno]
M. Tudorie; P. Cacciani; J. Cosléou; F. Herlemont; M. Khelkhal; C. Puzzarini; S. Maret; and C. Kahane, NUCLEAR SPIN CONVERSION OF FORMALDEHYDE IN PROTOSTAR ENVIRONMENTS INDUCED BY NON REACTIVE COLLISIONS, in: The 19th International Conference on High Reolution Molecular Spectroscopy, PRAGA, ITC Press, 2006, pp. 167 - 167 (atti di: The 19th International Conference on High Reolution Molecular Spectroscopy, Praga, 29/8/2006 - 2/9/2006) [Riassunto (Abstract)]
C. Puzzarini, Triatomic molecules, radicals and ions: how accurate can ab initio calculations be?, in: Science and Supercomputing at Cineca - Report 2005, BOLOGNA, CINECA (printed by Monograf s.r.l.), 2006, pp. 183 - 188 (Science and Supercomputing at Cineca) [Capitolo/Saggio in libro]
A. Gambi; C. Puzzarini, Theoretical Investigations of H2CN2 molecule, HCN2 radicals and their Ions, in: Science and Supercomputing at Cineca - Report 2005, BOLOGNA, CINECA (printed by: Monograf s.r.l.), 2006, pp. 261 - 270 (Science and Supercomputing at Cineca) [Capitolo/Saggio in libro]
F. Tinti; L. Bizzocchi; C. Degli Esposti; L. Dore, Millimeter-wave spectroscopy of SHD2+ and its symmetric isotopologues. Determination of the molecular structure of the sulfonium ion, «JOURNAL OF MOLECULAR SPECTROSCOPY», 2006, 240, pp. 202 - 209 [Articolo in rivista]
G. Brizzi; C. Puzzarini; A. Perrin; J. Orphal; H. Willner; P. Garcia, High resolution Fourier transform infrared spectrum of 79Br14N18O: Analysis of the v1 band, «JOURNAL OF MOLECULAR STRUCTURE», 2005, 742, pp. 37 - 41 [Articolo in rivista]
G. Cazzoli; L. Dore; C. Puzzarini; B. Bakrib; J.-M. Colmont; F. Rohart; G. Wlodarczak, Experimental determination of air-broadening parameters of pure rotational transitions of HNO3: intercomparison of measurements by using different techniques., «JOURNAL OF MOLECULAR SPECTROSCOPY», 2005, 229, pp. 158 - 169 [Articolo in rivista]
C.L. Verdes; S.A. Buehler; A. Perrin; J.-M. Flaud; J. Demaison; G. Wlodarczak; J.-M. Colmont; G. Cazzoli; C. Puzzarini, A sensitivity study on spectroscopic parameter accuracies for a mm/sub-mm limb sounder instrument., «JOURNAL OF MOLECULAR SPECTROSCOPY», 2005, 229, pp. 266 - 275 [Articolo in rivista]
G. Cazzoli; C. Puzzarini, The Lamb-dip spectrum of the J = 1 - 0 transition of DF: crossing resonances and hyperfine components., «JOURNAL OF MOLECULAR SPECTROSCOPY», 2005, 231, pp. 124 - 130 [Articolo in rivista]
J.-M.Colmont; B. Bakri; F. Rohart; G. Wlodarczak; J. Demaison; G. Cazzoli; L. Dore; C. Puzzarini, Intercomparison between ozone broadening parameters retrieved from millimetre-wave measurements by using different techniques., «JOURNAL OF MOLECULAR SPECTROSCOPY», 2005, 231, pp. 171 - 187 [Articolo in rivista]
G. Cazzoli; C. Puzzarini; J. Gauss., The rare isotopomers of HCN: HC15N and DC15N. Rotational spectrum and resolved nuclear hyperfine structures due to 15N and D., «ASTROPHYSICAL JOURNAL SUPPLEMENT SERIES», 2005, 159, pp. 181 - 189 [Articolo in rivista]
G. Cazzoli; C. Puzzarini, Observation of OD- by microwave spectroscopy., «THE JOURNAL OF CHEMICAL PHYSICS», 2005, 123, pp. 041101-1 - 041101-4 [Articolo in rivista]
G. Cazzoli ; C. Puzzarini, The Lamb-dip spectrum of the J + 1 ← J (J = 0, 1, 3–8) transitions of H13CN: The nuclear hyperfine structure due to H, 13C, and 14N, «JOURNAL OF MOLECULAR SPECTROSCOPY», 2005, 233, pp. 280 - 289 [Articolo in rivista]
A. Perrin; C. Puzzarini; J.-M. Colmont; C. Verdes; G. Wlodarczk; G. Cazzoli; S. Buehler; J.-M. Flaud; J. Demaison, Molecular line parameters for "MASTER" (Millimeter wave Acquisitions for Stratosphere/Troposphere Exchange Research) database, «JOURNAL OF ATMOSPHERIC CHEMISTRY», 2005, 50, pp. 161 - 205 [Articolo in rivista]
L. Bizzocchi; C. Degli Esposti; L. Dore; C. Puzzarini, Lamb-dip millimetre-wave spectroscopy of HCP: experimental and theoretical determination of 31P nuclear spin-rotation coupling constant and magnetic shielding., «CHEMICAL PHYSICS LETTERS», 2005, 408, pp. 13 - 18 [Articolo in rivista]
C. Degli Esposti; L. Bizzocchi; P. Botschwina; K.M.T. Yamada; G. Winnewisser; S. Thorwirth; P. Förster, Vibrationally excited states of HC5N: millimeter-wave spectroscopy and coupled cluster calculations., «JOURNAL OF MOLECULAR SPECTROSCOPY», 2005, 230, pp. 185 - 195 [Articolo in rivista]
L. Bizzocchi; C. Degli Esposti; C. Puzzarini, Millimeter-wave spectroscopy and coupled cluster calculations for FCP., in: Nineteenth Colloquium on High Resolution Molecular Spectroscopy, SALAMANCA, D. Bermejo, J.L. Domenech, M.A. Moreno, 2005, pp. 294 - 294 (atti di: Salamanca 2005. Nineteenth Colloquium on High Resolution Molecular Spectroscopy, Salamanca, 11-16 settembre 2005) [Riassunto (Abstract)]
L. Bizzocchi; C. Degli Esposti, Millimeter and submillimeter-wave spectroscopy of silicon difluoride., in: Nineteenth Colloquium on High Resolution Molecular Spectroscopy., SALAMANCA, D. Bermejo, J.L. Domenech, M.A. Moreno, 2005, pp. 387 - 387 (atti di: Salamanca 2005. Nineteenth Colloquium on High Resolution Molecular Spectroscopy., Salamanca, 11-16 settembre 2005) [Riassunto (Abstract)]
C. Puzzarini; G. Cazzoli; J. Gauss, "Fine- and hyperfine-structure of rotational spectra predicted by ab initio computations"., in: Computational Tools for Molecules, Clusters and Nanostructures, KARLSRUHE, s.n, 2005, pp. 88 - 88 (atti di: 'Computational Tools for Molecules, Clusters and Nanostructures. An International Conference in honour of Reinhart Ahlrichs', Karlsruhe, Germania, 23-26 Gennaio 2005) [Riassunto (Abstract)]
C. Puzzarini; G. Cazzoli; J. Gauss, "Fine- and hyperfine-structure of rotational spectra predicted by ab initio computations"., in: "Programme and Abstracts of the 19th Colloquium on High Resolution Molecular Spectrosocpy', SALAMANCA, s.n, 2005, pp. 121 - 121 (atti di: '19th Colloquium on High Resolution Molecular Spectrosocpy', Salamanca (Spagna), 11-16 Settembre 2005) [Riassunto (Abstract)]