Here you can find the updated list of all the publications of CSGI members and affilated staff. Please note that the only publications listed here are those published after the affilation of each member. If you are interested in the whole bibliography of CSGI members, including articles and books published before affilation to CSGI, please refer to academic research databases, such as Scopus, Web Of Science, Google Scholar, ect.
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The Electric Field Morphology of Plasmonic Picocavities
- Tommaso Giovannini - Nicoli L. - Corni S. - Chiara CappelliModeling infrared and vibrational circular dichroism spectra of complex systems: the DFTB/fluctuating charges route
- Lafiosca P. - Gómez S. - Melega L. - Tommaso Giovannini - Chiara CappelliModeling Raman Spectra in Complex Environments: From Solutions to Surface-Enhanced Raman Scattering
- Tommaso Giovannini - Gómez S. - Chiara CappelliMixed atomistic-implicit quantum/classical approach to molecular nanoplasmonics
- Illobre P.G. - Lafiosca P. - Bonatti L. - Tommaso Giovannini - Chiara CappelliFully Polarizable Multiconfigurational Self-Consistent Field/Fluctuating Charges Approach
- Sepali C. - Goletto L. - Lafiosca P. - Rinaldi M. - Tommaso Giovannini - Chiara CappelliAtomistic Multiscale Modeling of Colloidal Plasmonic Nanoparticles
- Nicoli L. - Sodomaco S. - Lafiosca P. - Tommaso Giovannini - Chiara CappelliReal-Time Formulation of Atomistic Electromagnetic Models for Plasmonics
- Lafiosca P. - Nicoli L. - Pipolo S. - Corni S. - Tommaso Giovannini - Chiara CappelliModeling UV/Vis Absorption Spectra of Food Colorants in Solution: Anthocyanins and Curcumin as Case Studies
- Gómez S. - Lafiosca P. - Tommaso GiovanniniMultiscale modeling of surface enhanced fluorescence
- Grobas Illobre P. - Lafiosca P. - Guidone T. - Mazza F. - Tommaso Giovannini - Chiara CappelliComputational Spectroscopy of Aqueous Solutions: The Underlying Role of Conformational Sampling
- Sepali C. - Gómez S. - Grifoni E. - Tommaso Giovannini - Chiara CappelliTime-Dependent Multilevel Density Functional Theory
- Tommaso Giovannini - Scavino M. - Henrik KochDeciphering the structure of deep eutectic solvents: A computational study from the solute's viewpoint
- Sepali C. - Skoko S. - Guglielmero L. - Tommaso Giovannini - Mezzetta A. - D'Andrea F. - Pomelli C.S. - Guazzelli L. - Chiara CappelliEffective fully polarizable QM/MM approaches to compute Raman and Raman Optical Activity spectra in aqueous solution
- Sepali C. - Lafiosca P. - Gómez S. - Tommaso Giovannini - Chiara CappelliFully atomistic modeling of plasmonic bimetallic nanoparticles: nanoalloys and core-shell systems
- Nicoli L. - Lafiosca P. - Grobas Illobre P. - Bonatti L. - Tommaso Giovannini - Chiara CappelliClose-Up Look at Electronic Spectroscopic Signatures of Common Pharmaceuticals in Solution
- Gómez S. - Ambrosetti M. - Tommaso Giovannini - Chiara CappelliMultiscale Frozen Density Embedding/Molecular Mechanics Approach for Simulating Magnetic Response Properties of Solvated Systems
- Lafiosca P. - Rossi F. - Franco Egidi - Tommaso Giovannini - Chiara CappelliComputational Insights into the Adsorption of Ligands on Gold Nanosurfaces
- Sodomaco S. - Gómez S. - Tommaso Giovannini - Chiara CappelliMixed Quantum/Classical Approach to Surface-Enhanced Spectroscopies
- Tommaso Giovannini - Chiara CappelliStrong Coupling in Chiral Cavities: Nonperturbative Framework for Enantiomer Discrimination
- Riso R.R. - Grazioli L. - Ronca E. - Tommaso Giovannini - Henrik KochQM/Classical Modeling of Surface Enhanced Raman Scattering Based on Atomistic Electromagnetic Models
- Lafiosca P. - Nicoli L. - Bonatti L. - Tommaso Giovannini - Corni S. - Chiara CappelliContinuum vs. atomistic approaches to computational spectroscopy of solvated systems
- Tommaso Giovannini - Chiara CappelliErratum: Going beyond the Limits of Classical Atomistic Modeling of Plasmonic Nanostructures (The Journal of Physical Chemistry C (2021) 125:43 (23848-23863) DOI: 10.1021/acs.jpcc.1c04716)
- Lafiosca P. - Tommaso Giovannini - Benzi M. - Chiara CappelliTowards a cost-effective modeling of fluorescence in the condensed phase
- Skoko S. - Micheletti C. - Grifoni E. - Franco Egidi - Tommaso Giovannini - Pucci A. - Chiara CappelliMultiple Facets of Modeling Electronic Absorption Spectra of Systems in Solution
- Gómez S. - Tommaso Giovannini - Chiara CappelliWater Maintains the UV-Vis Spectral Features During the Insertion of Anionic Naproxen and Ibuprofen into Model Cell Membranes
- Rojas-Valencia N. - Gómez S. - Tommaso Giovannini - Chiara Cappelli - Restrepo A. - Núñez−Zarur F.Integrated Multiscale Multilevel Approach to Open Shell Molecular Systems
- Tommaso Giovannini - Marrazzini G. - Scavino M. - Henrik Koch - Chiara CappelliUV-Resonance Raman Spectra of Systems in Complex Environments: A Multiscale Modeling Applied to Doxorubicin Intercalated into DNA
- Gómez S. - Lafiosca P. - Franco Egidi - Tommaso Giovannini - Chiara CappelliStrain-Induced Plasmon Confinement in Polycrystalline Graphene
- Zanotto S. - Bonatti L. - Pantano M.F. - Mišeikis V. - Speranza G. - Tommaso Giovannini - Coletti C. - Chiara Cappelli - Tredicucci A. - Toncelli A.Assessing the quality of QM/MM approaches to describe vacuo-to-water solvatochromic shifts
- Nicoli L. - Tommaso Giovannini - Chiara CappelliLinear response properties of solvated systems: a computational study
- Goletto L. - Gómez S. - Andersen J.H. - Henrik Koch - Tommaso GiovanniniDo We Really Need Quantum Mechanics to Describe Plasmonic Properties of Metal Nanostructures?
- Tommaso Giovannini - Bonatti L. - Lafiosca P. - Nicoli L. - Castagnola M. - Illobre P.G. - Corni S. - Chiara CappelliFragment Localized Molecular Orbitals
- Tommaso Giovannini - Henrik KochAmide Spectral Fingerprints are Hydrogen Bonding-Mediated
- Gómez S. - Bottari C. - Franco Egidi - Tommaso Giovannini - Rossi B. - Chiara CappelliIn silico design of graphene plasmonic hot-spots
- Bonatti L. - Nicoli L. - Tommaso Giovannini - Chiara CappelliComputational hints for the simultaneous spectroscopic detection of common contaminants in water
- Uribe L. - Gómez S. - Franco Egidi - Tommaso Giovannini - Restrepo A.Ring Vibrations to Sense Anionic Ibuprofen in Aqueous Solution as Revealed by Resonance Raman
- Gómez S. - Rojas-Valencia N. - Tommaso Giovannini - Restrepo A. - Chiara CappelliAbsorption Properties of Large Complex Molecular Systems: The DFTB/Fluctuating Charge Approach
- Lafiosca P. - Gómez S. - Tommaso Giovannini - Chiara CappelliQuantum Mechanics/Fluctuating Charge Protocol to Compute Solvatochromic Shifts
- Ambrosetti M. - Skoko S. - Tommaso Giovannini - Chiara CappelliGoing beyond the Limits of Classical Atomistic Modeling of Plasmonic Nanostructures
- Lafiosca P. - Tommaso Giovannini - Benzi M. - Chiara CappelliUnlocking the power of resonance Raman spectroscopy: The case of amides in aqueous solution
- Gómez S. - Franco Egidi - Puglisi A. - Tommaso Giovannini - Rossi B. - Chiara CappelliOn the Transition from a Biomimetic Molecular Switch to a Rotary Molecular Motor
- Paolino M. - Tommaso Giovannini - Manathunga M. - Loredana Latterini - Zampini G. - Pierron R. - Léonard J. - Fusi S. - Giorgi G. - Giuliani G. - Cappelli A. - Chiara Cappelli - Olivucci M. An efficient and robust procedure to calculate absorption spectra of aqueous charged species applied to NO
Strong Coupling between Localized Surface Plasmons and Molecules by Coupled Cluster Theory
- Fregoni J. - Haugland T.S. - Pipolo S. - Tommaso Giovannini - Henrik Koch - Corni S.A polarizable three-layer frozen density embedding/molecular mechanics approach
- Franco Egidi - Angelico S. - Lafiosca P. - Tommaso Giovannini - Chiara CappelliEnergy-Based Molecular Orbital Localization in a Specific Spatial Region
- Tommaso Giovannini - Henrik KochMultilevel Density Functional Theory
- Marrazzini G. - Tommaso Giovannini - Scavino M. - Franco Egidi - Chiara Cappelli - Henrik KochCombining multilevel Hartree-Fock and multilevel coupled cluster approaches with molecular mechanics: a study of electronic excitations in solutions
- Goletto L. - Tommaso Giovannini - Folkestad S.D. - Henrik KochAbsorption spectra of xanthines in aqueous solution: A computational study
- Gómez S. - Tommaso Giovannini - Chiara CappelliPlasmonic Resonances of Metal Nanoparticles: Atomistic vs. Continuum Approaches
- Bonatti L. - Gil G. - Tommaso Giovannini - Corni S. - Chiara Cappelli