Publications

  1. P. Lafiosca, T. Giovannini, M. Benzi, C. Cappelli, “Going Beyond the Limits of Classical Atomistic Modeling of Plasmonic Nanostructures”, J. Phys. Chem. C. 2021, DOI: 10.1021/acs.jpcc.1c04716.
  2. Matteo Ambrosetti, Sulejman Skoko, Tommaso Giovannini, Chiara Cappelli “Quantum Mechanics/Fluctuating Charge Protocol to Compute Solvatochromic Shifts“, J. Chem. Theory Comput. 2021, DOI: 10.1021/acs.jctc.1c00763.
  3. F. Egidi, S. Angelico, P. Lafiosca, T. GiovanniniC. Cappelli “A polarizable three-layer frozen density embedding/molecular mechanics approach“, J. Chem. Phys. 2021, DOI: 10.1063/5.0045574.
  4. T. Giovannini, L. Bonatti, M. Polini, C. CappelliGraphene Plasmonics: Fully Atomistic Approach for Realistic Structures“, J. Phys. Chem. Lett. 2020, DOI: 10.1021/acs.jpclett.0c02051.
  5. T. Giovannini, F. Egidi, C. Cappelli “Molecular Spectroscopy of Aqueous Solutions: a Theoretical Perspective”, Chem. Soc. Rev. 2020, DOI: 10.1039/C9CS00464E.
  6. L. Bonatti, G. Gil, T. Giovannini, S. Corni, C. Cappelli “Plasmonic Resonances of Metal Nanoparticles: Atomistic vs. Continuum Approaches”, Front. Chem. 2020, DOI: 10.3389/fchem.2020.00340.