Abstract
Discrete breathers (DB) are spatially localized vibrational modes of large amplitude in a defect-free crystal lattice. In this work, for the first time, two-dimensional DBs based on a two-component delocalized nonlinear vibrational mode (DNVM) are excited in a single (111) close-packed atomic plane in fcc metals (Al, Cu, and Ni). DNVM provides a pattern according to which the initial displacements of atoms from their equilibrium lattice positions are set. Classical molecular dynamics simulations have demonstrated the possibility to excite a long-lived two-dimensional DB with the energy of the order of 0.5–1.0 eV per oscillating atom. The two-dimensional DBs have a hard-type of nonlinearity and a lifetime of 12–24 ps, after which they decay into one-dimensional DBs, which, in turn, decay into zero-dimensional DBs, which also have a sufficiently long lifetime. A new class of two-dimensional DBs expands our understanding of the variety of spatially localized vibrational modes in nonlinear fcc lattices.
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This manuscript has no associated data or the data will not be deposited. [Authors’ comment: The raw/processed data required to reproduce these findings cannot be shared at this time as the data also form part of an ongoing study.]
References
A.S. Dolgov, On localization of oscillations in nonlinear crystal structure. Sov. Phys. Solid State 28, 907 (1986)
A.J. Sievers, S. Takeno, Intrinsic localized modes in anharmonic crystals. Phys. Rev. Lett. 61(8), 970–973 (1988)
J.B. Page, Asymptotic solutions for localized vibrational modes in strongly anharmonic periodic systems. Phys. Rev. B 41(11), 7835–7838 (1990)
S. Flach, A.V. Gorbach, Discrete breathers - Advances in theory and applications. Phys. Rep. 467(1–3), 1–116 (2008)
S. Flach, C.R. Willis, Discrete breathers. Phys. Rep. 295(5), 181–264 (1998)
S.V. Dmitriev, E.A. Korznikova, Y.A. Baimova, M.G. Velarde, Discrete breathers in crystals. Phys. - Uspekhi 59(5), 446–461 (2016)
R.I. Babicheva, A.S. Semenov, E.G. Soboleva, A.A. Kudreyko, K. Zhou, S.V. Dmitriev, Discrete breathers in a triangular \(\beta \)-Fermi-Pasta-Ulam-Tsingou lattice. Phys. Rev. E 103(5), 052202 (2021)
L. Kavitha, A. Muniyappan, A. Prabhu, S. Zdravkovic, S. Jayanthi, D. Gopi, Nano breathers and molecular dynamics simulations in hydrogen-bonded chains. J. Biol. Phys. 39(1), 15–35 (2013)
S.V. Dmitriev, A.P. Chetverikov, M.G. Velarde, Discrete breathers in 2D and 3D crystals. Phys. Status Solidi B 252(7), 1682–1686 (2015)
A. Fraile, E.N. Koukaras, K. Papagelis, N. Lazarides, G.P. Tsironis, Long-lived discrete breathers in free-standing graphene. Chaos Solit. Fractals 87, 262–267 (2016)
G.M. Chechin, S.V. Dmitriev, I.P. Lobzenko, D.S. Ryabov, Properties of discrete breathers in graphane from ab initio simulations. Phys. Rev. B 90(4), 045432 (2014)
L.Z. Khadeeva, S.V. Dmitriev, Discrete breathers in crystals with NaCl structure. Phys. Rev. B 81(21), 214306 (2010)
R.T. Murzaev, D.V. Bachurin, E.A. Korznikova, S.V. Dmitriev, Localized vibrational modes in diamond. Phys. Lett. A 381(11), 1003–1008 (2017)
O.V. Bachurina, R.T. Murzaev, A.S. Semenov, E.A. Korznikova, S.V. Dmitriev, Properties of moving discrete breathers in beryllium. Phys. Solid State 60(5), 989–994 (2018)
R.T. Murzaev, A.A. Kistanov, V.I. Dubinko, D.A. Terentyev, S.V. Dmitriev, Moving discrete breathers in bcc metals V, Fe and W. Comp. Mater. Sci. 98, 88–92 (2015)
K.A. Krylova, I.P. Lobzenko, A.S. Semenov, A.A. Kudreyko, S.V. Dmitriev, Spherically localized discrete breathers in bcc metals V and Nb. Comput. Mater. Sci. 180, 109695 (2020)
R.T. Murzaev, R.I. Babicheva, K. Zhou, E.A. Korznikova, S.Y. Fomin, V.I. Dubinko, S.V. Dmitriev, Discrete breathers in alpha-uranium. Eur. Phys. J. B 89(7), 168 (2016)
N.N. Medvedev, M.D. Starostenkov, M.E. Manley, Energy localization on the Al sublattice of Pt\(_{3}\)Al with L1(2) order. J. Appl. Phys. 114(21), 213506 (2013)
P.V. Zakharov, E.A. Korznikova, S.V. Dmitriev, E.G. Ekomasov, K. Zhou, Surface discrete breathers in Pt\(_{3}\)Al intermetallic alloy. Surf. Sci. 679, 1–5 (2019)
O.V. Bachurina, Linear discrete breather in FCC metals. Comput. Mater. Sci. 160, 217–221 (2019)
O.V. Bachurina, R.T. Murzaev, D.V. Bachurin, Molecular dynamics study of two-dimensional discrete breather in nickel. J. Micromech. Mol. Phys. 3(4), 1950001 (2019)
O.V. Bachurina, Plane and plane-radial discrete breathers in FCC metals. Model. Simul. Mater. Sci. 27(5), 055001 (2019)
O.V. Bachurina, A.A. Kudreyko, Two-dimensional discrete breathers in FCC metals. Comput. Mater. Sci. 182, 109737 (2020)
G.M. Chechin, Computers and group-theoretical methods for studying structural phase transitions. Comput. Math. Appl. 17(1–3), 255–278 (1989)
G.M. Chechin, V.P. Sakhnenko, Interactions between normal modes in nonlinear dynamical systems with discrete symmetry. Exact results. Physica D 117(1–4), 43–76 (1998)
V.M. Burlakov, S.A. Kiselev, V.I. Rupasov, Localized excitations of uniform anharmonic lattices. JETP Lett. 51, 544–547 (1990)
T. Cretegny, T. Dauxois, S. Ruffo, A. Torcini, Localization and equipartition of energy in the \(\beta \)-FPU chain: chaotic breathers. Physica D 121, 109–126 (1998)
Y.S. Kivshar, M. Peyrard, Modulational instabilities in discrete lattices. Phys. Rev. A 46(6), 3198–3205 (1992)
E.A. Korznikova, D.V. Bachurin, S.Y. Fomin, A.P. Chetverikov, S.V. Dmitriev, Instability of vibrational modes in hexagonal lattice. Eur. Phys. J. B 90(2), 23 (2017)
E.A. Korznikova, S.Y. Fomin, E.G. Soboleva, S.V. Dmitriev, Highly symmetric discrete breather in a two-dimensional Morse crystal. JETP Lett. 103(4), 277–281 (2016)
S.A. Shcherbinin, M.N. Semenova, A.S. Semenov, E.A. Korznikova, G.M. Chechin, S.V. Dmitriev, Dynamics of a three-component delocalized nonlinear vibrational mode in graphene. Phys. Solid State 61(11), 2139–2144 (2019)
G.M. Chechin, D.S. Ryabov, S.A. Shcherbinin, Nonlinear vibrational modes in graphene: group-theoretical results. Lett. Mater. 6(1), 9–15 (2016)
D.S. Ryabov, G.M. Chechin, A. Upadhyaya, E.A. Korznikova, V.I. Dubinko, S.V. Dmitriev, Delocalized nonlinear vibrational modes of triangular lattices. Nonlinear Dyn. 102, 2793–2810 (2020)
S. Plimpton, Fast Parallel Algorithms for Short-Range Molecular-Dynamics. J. Comput. Phys. 117(1), 1–19 (1995)
LAMMPS: https://www.lammps.org/
S.M. Foiles, M.I. Baskes, M.S. Daw, Embedded-atom-method functions for the fcc metals Cu, Ag, Au, Ni, Pd, Pt, and their alloys. Phys. Rev. B 33(12), 7983–7991 (1986)
X.W. Zhou, H.N.G. Wadley, R.A. Johnson, D.J. Larson, N. Tabat, A. Cerezo, A.K. Petford-Long, G.D.W. Smith, P.H. Clifton, R.L. Martens, T.F. Kelly, Atomic scale structure of sputtered metal multilayers. Acta Mater. 49(19), 4005–4015 (2001)
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This work was supported by the Russian Science Foundation, Grant No. 21-12-00229.
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Bachurina, O.V., Kudreyko, A.A. Two-component localized vibrational modes in fcc metals. Eur. Phys. J. B 94, 218 (2021). https://doi.org/10.1140/epjb/s10051-021-00227-3
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DOI: https://doi.org/10.1140/epjb/s10051-021-00227-3