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Francesco Mauri

Researcher at Sapienza University of Rome

Publications -  369
Citations -  83302

Francesco Mauri is an academic researcher from Sapienza University of Rome. The author has contributed to research in topics: Phonon & Graphene. The author has an hindex of 85, co-authored 352 publications receiving 69332 citations. Previous affiliations of Francesco Mauri include University of Texas at Arlington & University of California, Berkeley.

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Large scsle quantum simulations: C60 Impacts on a semiconducting surface.

Giulia Galli, +1 more
- 19 Dec 1994 - 
TL;DR: Tight binding molecular dynamics simulations of impacts on the reconstructed diamond(111) surface are presented, carried out with an O(N) method and with cells containing 1140 atoms to provide detailed characterization of the microscopic processes occurring during the collision and allow the identification of three impact regimes.
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Critical Role of the Exchange Interaction for the Electronic Structure and Charge-Density-Wave Formation in TiSe 2

Maria Hellgren, +8 more
- 24 Oct 2017 - 
TL;DR: It is shown that the inclusion of screened exchange via hybrid functionals provides a unified description of the electronic and vibrational properties of TiSe_{2} and can generate a CDW phase where the electronic bands, the geometry, and the phonon frequencies are in agreement with experiments.
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First-principles calculation of 17O and 25Mg NMR shieldings in MgO at finite temperature: rovibrational effect in solids.

Stéphanie Rossano, +3 more
- 25 Mar 2005 - 
TL;DR: The temperature dependence of (17)O and (25)Mg NMR chemical shifts in solid MgO have been calculated using a first-principles approach and it is shown that the chemical shift behavior with temperature cannot be explained by thermal expansion alone.
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Structural properties of lithium and sodium tetrasilicate glasses: Molecular dynamics simulations versus NMR experimental and first-principles data

Simona Ispas, +3 more
- 01 Feb 2010 - 
TL;DR: In this article, the structural properties of lithium tetrasilicate glass (LS4) obtained by combined classical and Car-Parrinello molecular dynamics simulations are compared with corresponding experimental results.
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Optomechanical Measurement of Thermal Transport in Two-Dimensional MoSe2 Lattices

Nicolas Morell, +10 more
- 02 Apr 2019 - 
TL;DR: In this article, the temperature dependence of both the thermal conductivity and the specific heat capacity of a transition metal dichalcogenide monolayer down to cryogenic temperature was measured.