| 1 |
Exploring the Maze of Cycloserine Conformers in the Gas Phase Guided by Microwave Spectroscopy and Quantum Chemistry
Alonso ER, Fuse M, Leon I, Puzzarini C, Alonso JL, Barone V
Journal of Physical Chemistry A, 125(10), 2121, 2021 |
| 2 |
Rich Collection of n-Propylamine and Isopropylamine Conformers: Rotational Fingerprints and State-of-the-Art Quantum Chemical Investigation
Melosso M, Melli A, Spada L, Zheng Y, Chen JH, Li M, Lu T, Feng G, Gou Q, Dore L, Barone V, Puzzarini C
Journal of Physical Chemistry A, 124(7), 1372, 2020 |
| 3 |
Accuracy and Interpretability: The Devil and the Holy Grail. New Routes across Old Boundaries in Computational Spectroscopy
Puzzarini C, Bloino J, Tasinato N, Barone V
Chemical Reviews, 119(13), 8131, 2019 |
| 4 |
Unbiased Determination of Absolute Configurations by vis-a-vis Comparison of Experimental and Simulated Spectra: The Challenging Case of Diplopyrone
Fuse M, Mazzeo G, Longhi G, Abbate S, Masi M, Evidente A, Puzzarini C, Barone V
Journal of Physical Chemistry B, 123(43), 9230, 2019 |
| 5 |
Accurate Vibrational-Rotational Parameters and Infrared Intensities of 1-Bromo-1-fluoroethene: A Joint Experimental Analysis and Ab Initio Study
Charmet AP, Stoppa P, Giorgianni S, Bloino J, Tasinato N, Camimeo I, Biczysko M, Puzzarini C
Journal of Physical Chemistry A, 121(17), 3305, 2017 |
| 6 |
Nuclear Spin Conversion in CH4: A Multichannel Relaxation Mechanism
Cacciani P, Cosleou J, Khelkhal M, Cermak P, Puzzarini C
Journal of Physical Chemistry A, 120(2), 173, 2016 |
| 7 |
Semi-Experimental Equilibrium Structure Determinations by Employing B3LYP/SNSD Anharmonic Force Fields: Validation and Application to Semirigid Organic Molecules (vol 119, pg 2058, 2015)
Piccardo M, Penocchio E, Puzzarini C, Biczysko M, Barone V
Journal of Physical Chemistry A, 120(20), 3754, 2016 |
| 8 |
Structural and Energetic Characterization of Prebiotic Molecules: The Case Study of Formamide and Its Dimer
Alessandrini S, Puzzarini C
Journal of Physical Chemistry A, 120(27), 5257, 2016 |
| 9 |
Isomerism of Cyanomethanimine: Accurate Structural, Energetic, and Spectroscopic Characterization
Puzzarini C
Journal of Physical Chemistry A, 119(47), 11614, 2015 |
| 10 |
Microsolvation of 2-Thiouracil: Molecular Structure and Spectroscopic Parameters of the Thiouracil-Water Complex
Puzzarini C, Biczysko M
Journal of Physical Chemistry A, 119(21), 5386, 2015 |
