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Competition between different mechanisms of stability loss for the (C20)2 cluster dimer

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Abstract

The thermal stability of the (C20)2 cluster dimer consisting of two C20 fullerenes has been numerically examined using the tight-binding method. The simulation of the dynamics of the (C20)2 dimer at temperatures of T = 2000–3500 K shows that the finite lifetime τ of this metastable system is determined by two fundamentally different processes: the decay of one of the C20 fullerenes and the coalescence of two C20 fullerenes to the C40 cluster. The activation energies for these processes. E a ≈ 3.4 and 2.7 eV, respectively, as well as their frequency factors, have been determined by analyzing the τ(T) dependence.

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Original Russian Text © L.A. Openov, A.I. Podlivaev, 2006, published in Pis’a v Zhurnal Éksperimental’noĭ i Teoreticheskoĭ Fiziki, 2006, Vol. 84, No. 4, pp. 217–221.

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Openov, L.A., Podlivaev, A.I. Competition between different mechanisms of stability loss for the (C20)2 cluster dimer. Jetp Lett. 84, 185–189 (2006). https://doi.org/10.1134/S0021364006160041

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