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The Frenkel-Kontorova chain with a free end is used to study initiation and propagation of crowdions (anti-kinks) caused by impact of a molecule consisting of K atoms. It is found that molecules with 1 < K < 10 are more efficient in initiation of crowdions as compared to single atom (K = 1) because total energy needed to initiate the crowdions by molecules is smaller. This happens because single atom can initiate in the chain only sharp, fast-moving crowdions that requires a relatively large energy. Molecule has finite length, that is why it is able to excite a wider crowdion with a smaller velocity and smaller energy. Our results can shed light on the atomistic mechanisms of mass transfer in crystals subject to atom and molecule bombardment.
By means of atomistic simulations, we demonstrate that a dislocation core exhibits intermittent quasistatic restructuring during incremental shear within the same Peierls valley. This can be regarded as a stick-slip transition, which is also reproduc
A 1D model of interacting particles moving over a periodic substrate and in a position dependent temperature profile is considered. When the substrate and the temperature profile are spatially asymmetric a center-of-mass velocity develops, correspond
Simple models for friction are typically one-dimensional, but real interfaces are two-dimensional. We investigate the effects of the second dimension on static and dynamic friction by using the Frenkel-Kontorova (FK) model. We study the two most stra
We solved the Frenkel-Kontorova model with the potential $V(u)= -frac{1}{2} |lambda|(u-{rm Int}[u]-frac{1}{2})^2$ exactly. For given $|lambda|$, there exists a positive integer $q_c$ such that for almost all values of the tensile force $sigma$, the w
We study numerically phonon modes of the classical one-dimensional Frenkel-Kontorova chain, in the regime of pinned phase characterized by the phonon gap and devils staircase, as well as by a large number of states (configurational excitations), whic