Abstract
It is known that, in a molecular dynamics model of Pt3Al crystal, a discrete breather (DB) with soft type nonlinearity (DB1) can be excited, which is characterized by a high degree of localization on a light atom (Al), stationarity, as well as a frequency that lies in the gap of the phonon spectrum and decreases with increasing amplitude of the DB. In this paper, it is demonstrated that a DB with hard type nonlinearity (DB2) can be excited in a Pt3Al nanofiber; this DB is localized on several light atoms, can move along the crystal, and has a frequency that lies above the phonon spectrum and increases with the DB amplitude. It is noteworthy that the presence of free surfaces of a nanofiber does not prevent the existence of DB1 and DB2 in it. Collisions of two DBs counterpropagating with equal velocities, as well as a collision of DB2 with a standing DB1, are considered. Two colliding DBs with hard type nonlinearity are repelled almost elastically, losing only insignificant part of their energy during the interaction. DB2 is also reflected from a standing DB1; in this case, the energy of the breathers is partially scattered into the Al sublattice. The results obtained indicate that DBs can transfer energy along a crystal over large distances. During the collision of two or more DBs, the energy localized in space can be as high as a few electron-volts; this allows one to raise the question of the participation of DBs in structural transformations of the crystal.
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Original Russian Text © P.V. Zakharov, M.D. Starostenkov, S.V. Dmitriev, N.N. Medvedev, A.M. Eremin, 2015, published in Zhurnal Eksperimental’noi i Teoreticheskoi Fiziki, 2015, Vol. 148, No. 2, pp. 252–257.
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Zakharov, P.V., Starostenkov, M.D., Dmitriev, S.V. et al. Simulation of the interaction between discrete breathers of various types in a Pt3Al crystal nanofiber. J. Exp. Theor. Phys. 121, 217–221 (2015). https://doi.org/10.1134/S1063776115080154
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DOI: https://doi.org/10.1134/S1063776115080154