| 1 |
Magnetic Circular Dichroism of Naphthalene Derivatives: A Coupled Cluster Singles and Approximate Doubles and Time-Dependent Density Functional Theory Study
Ghidinelli S, Longhi G, Abbate S, Hattig C, Coriani S
Journal of Physical Chemistry A, 125(1), 243, 2021 |
| 2 |
Toward Fully Unsupervised Anharmonic Computations Complementing Experiment for Robust and Reliable Assignment and Interpretation of IR and VCD Spectra from Mid-IR to NIR: The Case of 2,3-Butanediol and trans-1,2-Cyclohexanediol
Paoloni L, Mazzeo G, Longhi G, Abbate S, Fuse M, Bloino J, Barone V
Journal of Physical Chemistry A, 124(5), 1011, 2020 |
| 3 |
Solvent Effects and Aggregation Phenomena Studied by Vibrational Optical Activity and Molecular Dynamics: The Case of Pantolactone
Ghidinelli S, Abbate S, Koshoubu J, Araki Y, Wada T, Longhi G
Journal of Physical Chemistry B, 124(22), 4512, 2020 |
| 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 |
l-Stercobilin-HCl and d-Urobilin-HCl. Analysis of Their Chiroptical and Conformational Properties by VCD, ECD, and CPL Experiments and MD and DFT Calculations
Ghidinelli S, Abbate S, Boiadjiev SE, Lightner DA, Longhi G
Journal of Physical Chemistry B, 122(51), 12351, 2018 |
| 6 |
Vibrational Optical Activity of BODIPY Dimers: The Role of Magnetic-Electric Coupling in Vibrational Excitons
Abbate S, Bruhn T, Pescitelli G, Longhi G
Journal of Physical Chemistry A, 121(1), 394, 2017 |
| 7 |
Chiral-at-Metal Phosphorescent Square-Planar Pt(II)-Complexes from an Achiral Organometallic Ligand
Schulte TR, Holstein JJ, Krause L, Michel R, Stalke D, Sakuda E, Umakoshi K, Longhi G, Abbate S, Clever GH
Journal of the American Chemical Society, 139(20), 6863, 2017 |
| 8 |
Chiral Peropyrene: Synthesis, Structure, and Properties
Yang WL, Longhi G, Abbate S, Lucote A, Tommasini M, Villani C, Catalano VJ, Lykhin AO, Varganov SA, Chalifoux WA
Journal of the American Chemical Society, 139(37), 13102, 2017 |
| 9 |
The connection between robustness angles and dissymmetry factors in vibrational circular dichroism spectra (vol 639, pg 320, 2015)
Longhi G, Tommasini M, Abbate S, Polavarapu PL
Chemical Physics Letters, 648, 208, 2016 |
| 10 |
pH Dependent Chiroptical Properties of (1R,2R)- and (1S,2S)-trans-Cyclohexane Diesters and Diamides from VCD, ECD, and CPL Spectroscopy
Mazzeo G, Abbate S, Longhi G, Castiglioni E, Boiadjiev SE, Lightner DA
Journal of Physical Chemistry B, 120(9), 2380, 2016 |
