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Michele Cutini

Showing results (1-10 of 11) with videos related to

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The Journal of Chemical Physics|August 22, 2021
Infrared harmonic features of collagen models at B3LYP-D3: From amide bands to the THz regionMichele Cutini, Piero Ugliengo
The Journal of Physical Chemistry Letters|November 19, 2019
Elucidating the Nature of Interactions in Collagen Triple-Helix WrappingMichele Cutini, Stefano Pantaleone, Piero Ugliengo
Journal of Chemical Theory and Computation|December 16, 2016
Method Dependence of Proline Ring Flexibility in the Poly-l-Proline Type II PolymerMichele Cutini, Marta Corno, Piero Ugliengo
Journal of Chemical Theory and Computation|July 2, 2020
Exfoliation Energy of Layered Materials by DFT-D: Beware of Dispersion!Michele Cutini, Lorenzo Maschio, Piero Ugliengo
ACS Omega|August 29, 2019
Cost-Effective Quantum Mechanical Approach for Predicting Thermodynamic and Mechanical Stability of Pure-Silica ZeolitesMichele Cutini, Bartolomeo Civalleri, Piero Ugliengo
The Journal of Physical Chemistry. B|August 1, 2019
Decoding Collagen Triple Helix Stability by Means of Hybrid DFT SimulationsMichele Cutini, Massimo Bocus, Piero Ugliengo
Journal of Chemical Theory and Computation|March 23, 2021
Balancing Cost and Accuracy in Quantum Mechanical Simulations on Collagen Protein ModelsMichele Cutini, Irene Bechis, Marta Corno, et al.
ACS Applied Nano Materials|September 5, 2022
Nanoscale MXene Interlayer and Substrate Adhesion for Lubrication: A Density Functional Theory StudyEdoardo Marquis, Michele Cutini, Babak Anasori, et al.
Journal of Chemical Theory and Computation|June 16, 2016
Assessment of Different Quantum Mechanical Methods for the Prediction of Structure and Cohesive Energy of Molecular CrystalsMichele Cutini, Bartolomeo Civalleri, Marta Corno, et al.
Journal of the American Chemical Society|August 25, 2020
Structure and Reactivity of Oxygen-Bridged Diamino Dicopper(II) Complexes in Cu-Ion-Exchanged Chabazite Catalyst for NH<sub>3</sub>-Mediated Selective Catalytic ReductionChiara Negri, Tommaso Selleri, Elisa Borfecchia, et al.
Pageof 2

Showing results (1-10 of 11) with videos related to

Sort By:
Pageof 2
The Journal of Chemical Physics|August 22, 2021
Infrared harmonic features of collagen models at B3LYP-D3: From amide bands to the THz regionMichele Cutini, Piero Ugliengo
The Journal of Physical Chemistry Letters|November 19, 2019
Elucidating the Nature of Interactions in Collagen Triple-Helix WrappingMichele Cutini, Stefano Pantaleone, Piero Ugliengo
Journal of Chemical Theory and Computation|December 16, 2016
Method Dependence of Proline Ring Flexibility in the Poly-l-Proline Type II PolymerMichele Cutini, Marta Corno, Piero Ugliengo
Journal of Chemical Theory and Computation|July 2, 2020
Exfoliation Energy of Layered Materials by DFT-D: Beware of Dispersion!Michele Cutini, Lorenzo Maschio, Piero Ugliengo
ACS Omega|August 29, 2019
Cost-Effective Quantum Mechanical Approach for Predicting Thermodynamic and Mechanical Stability of Pure-Silica ZeolitesMichele Cutini, Bartolomeo Civalleri, Piero Ugliengo
The Journal of Physical Chemistry. B|August 1, 2019
Decoding Collagen Triple Helix Stability by Means of Hybrid DFT SimulationsMichele Cutini, Massimo Bocus, Piero Ugliengo
Journal of Chemical Theory and Computation|March 23, 2021
Balancing Cost and Accuracy in Quantum Mechanical Simulations on Collagen Protein ModelsMichele Cutini, Irene Bechis, Marta Corno, et al.
ACS Applied Nano Materials|September 5, 2022
Nanoscale MXene Interlayer and Substrate Adhesion for Lubrication: A Density Functional Theory StudyEdoardo Marquis, Michele Cutini, Babak Anasori, et al.
Journal of Chemical Theory and Computation|June 16, 2016
Assessment of Different Quantum Mechanical Methods for the Prediction of Structure and Cohesive Energy of Molecular CrystalsMichele Cutini, Bartolomeo Civalleri, Marta Corno, et al.
Journal of the American Chemical Society|August 25, 2020
Structure and Reactivity of Oxygen-Bridged Diamino Dicopper(II) Complexes in Cu-Ion-Exchanged Chabazite Catalyst for NH<sub>3</sub>-Mediated Selective Catalytic ReductionChiara Negri, Tommaso Selleri, Elisa Borfecchia, et al.
Pageof 2