2. Articole

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    Force constant matrices from keating interatomic potential: application to graphene [Articol]
    (CEP USM, 2014) Cocemasov, Alexandr
    Based on the Keating interatomic potential an analytical derivation of force constant matrices of two- and three body interactions in crystals is performed. Using the derive d force constant matrices the in-plane phonon energy spectra of graphene was calculated in the framework of a lattice dynamics theory. A reasonable agreement with experimental data was obtained. The results can extend the applicability of the current force constant models for investigation of crystal dynamics .