Modeling the Deformation of FCC Nickel Nanowires which Contain Hydrogen Atoms

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Using the method of molecular dynamics, FCC Ni nanowires containing hydrogen atoms in octahedral and tetrahedral pores are investigated in the course of high-speed uniaxial tensile loading along the direction <001>. The feature of structural transformations in Ni nanowires containing hydrogen is appearance on the stage of plastic deformation globular (spherical) formations consisting of hydrogen atoms

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21-25

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M. D. Starostenkov et al., "Modeling the Deformation of FCC Nickel Nanowires which Contain Hydrogen Atoms", Nano Hybrids and Composites, Vol. 15, pp. 21-25, 2017

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May 2017

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[1] Tsaregorodtsev A.I., Gorlov, N.V., Dem'yanov B.F., Starostenkov M.D. Atomic structure of antiphase boundaries and its impact on the lattice near the dislocations in ordered alloys with superstructure L12, Physics of Metals and Metallography. 1984. Vol. 58, Ed. 2. PP. 336-343.

[2] Dmitriev S.V., Kozlov E.V., Lomskih N.V., Starostenkov M.D. The kinetics of disorder in the two-dimensional model of the alloy, Russian Physics Journal. 1997. Vol. 40, №3, PP. 285-286.

[3] Berendsen H.J.C., Postma J.P.M., Van Gunsteren W.F., Dinola A., Haak J.R. Molecular-dynamics with coupling to an external bath, J. Chem. Phys. 1984. Vol. 81, № 8, PP. 3684-3690.

DOI: https://doi.org/10.1063/1.448118

[4] Potekaev A.I., Starostenkov M.D., Sinitsa N.V., Yashin A.V., Kharina E.G., Kulagina V.V. Mechanisms of structure rearrangements in a nanofiber model of intermetallic compound Ni3Al, containing long-period antiphase boundaries, in the course of high-speed uniaxial tensile loading , Russian Physics Journal. 2011. Vol. 53. № 8. PP. 818-826.

DOI: https://doi.org/10.1007/s11182-011-9495-5

[5] Potekaev A.I., Starostenkov M.D., Sinitsa N.V., Yashin A.V., Kharina E.G., Kulagina V.V. Peculiar behavior of structure rearrangement in nanofiber of intermetallic Ni3Al, containing long-period paired thermal anti-phase boundaries, under high-rate tensile uniaxial loading along <001>, Russian Physics Journal. 2011. Vol. 54. № 2. PP. 180-188.

DOI: https://doi.org/10.1007/s11182-011-9596-1

[6] Starostenkov M.D., Yashin A.V., Sinitca N.V., Dudnik E.A. Atomic mechanisms of structural reconstruction of FCC metallic nanowires in the process of tension deformation, In proceedings: 12th International Conference on Fracture 2009, ICF-12. 2009. PP. 1213-1221.

[7] Starostenkov M., Yashin A., Sinica N. Structural transformation in nanowires CuAu I with superstructure of L10 of tetragonal symmetry at uni-axial tension deformation, Key Engineering Materials. 2014. Vol. 592-593. PP. 51-54.

DOI: https://doi.org/10.4028/www.scientific.net/kem.592-593.51