Davide Mitoli

4PUBLICATIONS
9CO-AUTHORS
Theoretical quantum chemistryCondensed matter modelling and density functional theoryComputational methods in fluid flow, heat and mass transfer (incl. computational fluid dynamics)
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Publications (4)

|Sep 15, 2025
Anharmonicity in Molecular Crystals: Generalized Perturbation Theory Meets Periodic Computations.

Davide Mitoli, Alessandro Erba, Vincenzo Barone

|Mar 10, 2025
Anharmonic Vibrational States of Double-Well Potentials in the Solid State from DFT Calculations.

Davide Mitoli, Maria Petrov, Jefferson Maul

|Jul 15, 2024
Unveiling the Role of Spin Currents on the Giant Rashba Splitting in Single-Layer WSe2.

Alberto Boccuni, Bárbara Maria Teixeira Costa Peluzo, Filippo Bodo

|Jan 19, 2024
First-Principles Anharmonic Infrared and Raman Vibrational Spectra of Materials: Fermi Resonance in Dry Ice.

Davide Mitoli, Jefferson Maul, Alessandro Erba

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