Matteo Ferrabone

University of Turin — Italy

Materials Science · Physical Sciences

17h-index2.0kcitations25works0.02yr avg
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Research Topics

X-ray Diffraction in Crystallography(7), Advanced Chemical Physics Studies(6), Boron and Carbon Nanomaterials Research(6), Crystal Structures and Properties(5), Solid-state spectroscopy and crystallography(4)

Publications25 total

Elucidating the Interaction of CO<sub>2</sub> in the Giant Metal–Organic Framework MIL-100 through Large-Scale Periodic Ab Initio Modeling
The Journal of Physical Chemistry C·2019· 21 citedOpen Access
Anharmonic Vibrational States of Solids from DFT Calculations. Part I: Description of the Potential Energy Surface
Journal of Chemical Theory and Computation·2019· 55 citedOpen Access
Anharmonic Vibrational States of Solids from DFT Calculations. Part II: Implementation of the VSCF and VCI Methods
Journal of Chemical Theory and Computation·2019· 54 citedOpen Access
Elucidating the Interaction of CO₂ in the Giant Metal–Organic Framework MIL-100 through Large-Scale Periodic Ab Initio Modeling
The Journal of Physical Chemistry·2019
Thermodynamics and phonon dispersion of pyrope and grossular silicate garnets from ab initio simulations
Physics and Chemistry of Minerals·2015· 54 citedOpen Access
Exploitation of symmetry in periodic Self-Consistent-Field ab initio calculations: application to large three-dimensional compounds
Science China Chemistry·2014· 6 cited
C<scp>RYSTAL14</scp>: A program for the<i>ab initio</i>investigation of crystalline solids
International Journal of Quantum Chemistry·2014· 1.2k citedOpen Access
Symmetry and random sampling of symmetry independent configurations for the simulation of disordered solids
Journal of Physics Condensed Matter·2013· 36 citedOpen Access
Anisotropic displacement parameters for molecular crystals from periodic Hartree–Fock and density functional theory calculations
Acta Crystallographica Section A Foundations of Crystallography·2013· 55 citedOpen Access
The vibration properties of the (<i>n</i>,0) boron nitride nanotubes from <i>ab initio</i> quantum chemical simulations
The Journal of Chemical Physics·2013· 47 citedOpen Access
On the use of symmetry in configurational analysis for the simulation of disordered solids
Journal of Physics Condensed Matter·2013· 53 citedOpen Access
The electronic structure of MgO nanotubes. An ab initio quantum mechanical investigation
Physical Chemistry Chemical Physics·2013· 13 citedOpen Access
Accurate dynamical structure factors from<i>ab initio</i>lattice dynamics: The case of crystalline silicon
Journal of Computational Chemistry·2012· 70 citedOpen Access
<i>Ab initio</i>lattice dynamics of molecular crystals and related properties with the<i>CRYSTAL</i>code
Acta Crystallographica Section A Foundations of Crystallography·2012Open Access
Nuclear motion effects on the density matrix of crystals: An <i>ab initio</i> Monte Carlo harmonic approach
The Journal of Chemical Physics·2012· 8 citedOpen Access
A new massively parallel version of CRYSTAL for large systems on high performance computing architectures
Journal of Computational Chemistry·2012· 44 citedOpen Access
Static and dynamic coupled perturbed Hartree-Fock vibrational (hyper)polarizabilities of polyacetylene calculated by the finite field nuclear relaxation method
The Journal of Chemical Physics·2012· 6 citedOpen Access
Theoretical and experimental characterization of pyrazolato-based Ni(ii) metal–organic frameworks
Journal of Materials Chemistry·2012· 19 citedOpen Access
The infrared spectrum of ortho-enstatite from reflectance experiments and first-principle simulations
Monthly Notices of the Royal Astronomical Society·2011· 27 citedOpen Access
Vibrational contribution to static and dynamic (Hyper)polarizabilities of zigzag BN nanotubes calculated by the finite field nuclear relaxation method
International Journal of Quantum Chemistry·2011· 16 cited
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Frequent Co-authors

Roberto Dovesi(15), Roberto Orlando(10), Alessandro Erba(9), Bartolomeo Civalleri(8), Michel Rérat(8), Bernard Kirtman(5), Marco De La Pierre(4), Yves Nöel(4), Elisa Albanese(4), Claudio M. Zicovich‐Wilson(3), Philippe D’Arco(3), Philippe Carbonnière(3), Ian J. Bush(3), Lorenzo Maschio(2), Raffaella Demichelis(2), Jefferson Maul(2), Roberto Dovesi(2), Jacopo Baima(2), Sami Mustapha(2), R. Dovesi(2)