Consorzio Interuniversitario per lo sviluppo dei Sistemi a Grande Interfase
Center for Colloid and Surface Science


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.

You can use the search bar below to filter the publication list.


Deciphering 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 Cappelli
Journal of Molecular Liquids

Effective 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 Cappelli
Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy


Mixed Quantum/Classical Approach to Surface-Enhanced Spectroscopies

- Tommaso Giovannini - Chiara Cappelli
International Conference on Metamaterials, Photonic Crystals and Plasmonics

QM/Classical Modeling of Surface Enhanced Raman Scattering Based on Atomistic Electromagnetic Models

- Lafiosca P. - Nicoli L. - Bonatti L. - Tommaso Giovannini - Corni S. - Chiara Cappelli
Journal of Chemical Theory and Computation


Integrated Multiscale Multilevel Approach to Open Shell Molecular Systems

- Tommaso Giovannini - Marrazzini G. - Scavino M. - Henrik Koch - Chiara Cappelli
Journal of Chemical Theory and Computation

Strain-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.
ACS Photonics

Linear response properties of solvated systems: a computational study

- Goletto L. - Gómez S. - Andersen J.H. - Henrik Koch - Tommaso Giovannini
Physical Chemistry Chemical Physics

Do 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 Cappelli
ACS Photonics

Fragment Localized Molecular Orbitals

- Tommaso Giovannini - Henrik Koch
Journal of chemical theory and computation

Amide Spectral Fingerprints are Hydrogen Bonding-Mediated

- Gómez S. - Bottari C. - Franco Egidi - Tommaso Giovannini - Rossi B. - Chiara Cappelli
The journal of physical chemistry letters


Quantum Mechanics/Fluctuating Charge Protocol to Compute Solvatochromic Shifts

- Ambrosetti M. - Skoko S. - Tommaso Giovannini - Chiara Cappelli
Journal of Chemical Theory and Computation

On 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.
Journal of Physical Chemistry Letters

Multilevel Density Functional Theory

- Marrazzini G. - Tommaso Giovannini - Scavino M. - Franco Egidi - Chiara Cappelli - Henrik Koch
Journal of Chemical Theory and Computation


E T1.0: An open source electronic structure program with emphasis on coupled cluster and multilevel methods

- Folkestad S.D. - Kjønstad E.F. - Myhre R.H. - Andersen J.H. - Balbi A. - Coriani S. - Tommaso Giovannini - Goletto L. - Haugland T.S. - Hutcheson A. - Høyvik I.M. - Moitra T. - Paul A.C. - Scavino M. - Skeidsvoll A.S. - Tveten S.H. - Henrik Koch
Journal of Chemical Physics


Simulating vertical excitation energies of solvated dyes: From continuum to polarizable discrete modeling

- Tommaso Giovannini - Macchiagodena M. - Ambrosetti M. - Puglisi A. - Lafiosca P. - Lo Gerfo G. - Franco Egidi - Chiara Cappelli
International Journal of Quantum Chemistry

Fully Polarizable QM/Fluctuating Charge Approach to Two-Photon Absorption of Aqueous Solutions

- Di Remigio R. - Tommaso Giovannini - Ambrosetti M. - Chiara Cappelli - Frediani L.
Journal of Chemical Theory and Computation