List of Publications from the Rot&Comp Lab
C. Puzzarini; J. F. Stanton; J. Gauss, Quantum-chemical calculation of spectroscopic parameter for rotational spectroscopy, «INTERNATIONAL REVIEWS IN PHYSICAL CHEMISTRY», 2010, 29, pp. 273 - 367 [Scientific article]
C. Puzzarini, Molecular structure determination from quantum-chemical calculations: extrapolation to the complete basis set limit and additivity approximation, in: Twenty-third Austin Symposium on Molecular Structure and Dynamics, AUSTIN, s.n, 2010, pp. 33 - 33 (atti di: Twenty-third Austin Symposium on Molecular Structure and Dynamics, Austin, TX, 6 - 9 Marzo 2010) [Abstract]
C. Puzzarini, Benchmarking Quantum Chemistry with Rotational Spectroscopy or Benchmarking Rotational Spectroscopy with Quantum Chemistry?, in: First Principles Quantum Chemistry: from Elementary Reactions to Enzymes, BAD HERRENALB, s.n, 2010, pp. P52 - P52 (atti di: First Principles Quantum Chemistry: from Elementary Reactions to Enzymes. An international conference in honour of Hans-Joachim Werner's 60th birthday, Bad Herrenalb, Germany, 14-17 Aprile 2010) [Abstract]
P. C. Gómez; O. Gálvez; R. G. Mosteo; C. Puzzarini; R. Escribano, Clusters of atmospheric relevance: H2O/HCl/HNO3. Prediction of IR and MW spectra, «PHYSICAL CHEMISTRY CHEMICAL PHYSICS», 2010, 12, pp. 4617 - 4624 [Scientific article]
L. Dore ; L. Bizzocchi ; C. Degli Esposti ; J.Gauss, The magnetic hyperfine structure in the rotational spectrum of H2CNH., «JOURNAL OF MOLECULAR SPECTROSCOPY», 2010, 263, pp. 44 - 50 [Scientific article]
L. Bizzocchi ; C. Degli Esposti ; L. Dore, Submillimetre-wave spectrum of diacetylene and diacetylene-d2. Mol. Phys. 108, 2315-2323 (2010), «MOLECULAR PHYSICS», 2010, 108, pp. 2315 - 2323 [Scientific article]
G. Buffa; O. Tarrini; L. Dore; M. Meuwly, Experimental and Theoretical Study of the Broadening and Shifting of N2H+ Rotational Lines by Helium, «CHEMPHYSCHEM», 2010, 11, pp. 3141 - 3145 [Scientific article]
G. Cazzoli; L. Dore; C. Puzzarini; J. Gauss, The hyperfine structure in the rotational spectra of D2O: Lamb-dip measurements and quantum-chemical calculations, «MOLECULAR PHYSICS», 2010, 108, pp. 2335 - 2342 [Scientific article]
C. Puzzarini; V. Barone, Toward spectroscopic accuracy for open-shell systems: molecular structure and hyperfine coupling constants of H2CN, H2CP, NH2, and PH2 as test cases, «THE JOURNAL OF CHEMICAL PHYSICS», 2010, 133, pp. 184301/1 - 184301/11 [Scientific article]
C. Puzzarini, A theoretical study of the CH2N isomers: molecular structure and energetics, «INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY», 2010, 110, pp. 2483 - 2494 [Scientific article]
G. Cazzoli; C. Puzzarini; S. Stopkowicz; J. Gauss, Hyperfine structure in the rotational spectrum of trans-formic acid: Lamb-dip measurements and quantum-chemical calculations, «ASTRONOMY & ASTROPHYSICS», 2010, 520, pp. A64/1 - A64/6 [Scientific article]
C. Puzzarini; G. Cazzoli; J. Gauss, Rotational spectra of isotopic species of silyl fluoride. Part II: theoretical and empirical equilibrium structure, «JOURNAL OF MOLECULAR SPECTROSCOPY», 2010, 262, pp. 37 - 41 [Scientific article]
C. Puzzarini, Molecular structure determination: a testing ground for high-level quantum-chemical computations, in: International Meeting on Atomic and Molecular Physics and Chemistry. Book of Abstract, MADRID, s.n, 2010, pp. 53 - 53 (atti di: International Meeting on Atomic and Molecular Physics and Chemistry, Madrid, 29 Giugno - 2 Luglio 2010) [Abstract]
C. Puzzarini; G. Cazzoli; J. Gauss, Hyperfine structure of rotational spectra: interplay of experiment and theory, in: EUCMOS 2010, 30th European Congress on Molecular Spectroscopy. Books of Abstract, FIRENZE, s.n, 2010, pp. 237 - 237 (atti di: EUCMOS 2010. 30th European Congress on Molecular Spectroscopy, Firenze, 29 Agosto - 3 Settembre 2010) [Abstract]
C. Puzzarini; J. Gauss, Benchmarking Quantum Chemistry with Rotational Spectroscopy or Benchmarking Rotational Spectroscopy with Quantum Chemistry?, in: XXXIX congresso nazionale Divisione di Chimica Fisica. Atti del Congresso, MILANO, Arti Grafiche Baratelli, 2010, pp. 17 - 17 (atti di: XXXIX congresso nazionale Divisione di Chimica Fisica, Stresa (VB), 20-24 Settembre 2010) [Abstract]
C. Puzzarini, Rotational spectroscopy for astrophysical investigations, in: ACCADEMIA NAZIONALE DEI LINCEI. FONDAZIONE «GUIDO DONEGANI». CONVEGNO. ASTROCHIMICA: MOLECOLE NELLO SPAZIO E NEL TEMPO, ROMA, s.n, 2010, pp. 1 - 1 (atti di: ASTROCHIMICA: MOLECOLE NELLO SPAZIO E NEL TEMPO, Accademia dei Lincei. Roma, 4-5 Novembre 2010) [Abstract]
C. Puzzarini, 1) Introductory lecture on rotational spectroscopy 2) Rotational spectroscopy at work, in: 26th Winter School in Theoretical Chemistry. Accurate Molecular Structure by Experiment and Theory, HELSINKI, s.n, 2010, pp. 3 - 3 (atti di: 26th Winter School in Theoretical Chemistry. Accurate Molecular Structure by Experiment and Theory, Helsinki, 13-16 Dicembre 2010) [Abstract]
C. Puzzarini; G. Cazzoli; S. Stopkowicz; J. Gauss, Investigation of rotational spectra of isotopic species of trans-formic acid: a test case for the interplay between experiment and theory, in: The 21st International Conference on High Resolution Molecular Spectroscopy, POZNAN, Wydzial Chemii, Uniwersytet im. Adama Mickiewicza, 2010, pp. 124 - 124 (atti di: The 21st International Conference on High Resolution Molecular Spectroscopy, Poznan, 7-11 settembre 2010) [Abstract]
C. Puzzarini; J. Gauss, Benchmarking quantum chemistry with rotational spectroscopy or benchmarking rotational spectroscopy with quantum chemistry?, in: The 21st International Conference on High Resolution Molecular Spectroscopy, POZNAN, Wydzial Chemii, Uniwersytet im. Adama Mickiewicza, 2010, pp. 158 - 158 (atti di: The 21st International Conference on High Resolution Molecular Spectroscopy, Poznan, 7-11 settembre 2010) [Abstract]
P. Stoppa; A. Pietropolli Charmet; N. Tasinato; A. Baldacci; A. Baldan; S. Giorgianni; G. Cazzoli; C. Puzzarini; R. Wugt Larsen; S. Stopkowicz; J. Gauss, Microwave and high-resolution infrared studies of CHBrF2: the ground and v4=1 states, in: The 21st International Conference on High Resolution Molecular Spectroscopy, POZNAN, Wydzial Chemii, Uniwersytet im. Adama Mickiewicza, 2010, pp. 201 - 201 (atti di: The 21st International Conference on High Resolution Molecular Spectroscopy, Poznan, 7-11 settembre 2010) [Abstract]