Calculation of the parameters of the Lennard-Jones potential for pairs of identical atoms based on the properties of solid substances
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Gijzeman, O.L.J., Surface composition of binary metal alloys; Applicability of bulk parameters to surfaces, Surf. Sci., 1985, vol. 150, pp. 1–13.
Pirson, U., Kristallokhimiya i fizika metallov i splavov (Crystallochemistry and Physics of Metals and Alloys), Moscow: Mir, 1977, vol. 1.
Penkalya, T., Ocherki kristallokhimii (Essays on Crystallochemistry), Frank-Kamenetskii, V.A., Ed., Leningrad: Khimiya, 1974.
Glushko, V.P., Termicheskie konstanty veshchestv. Spravochnik (Thermal Constants of Substances. A Handbook), Moscow: VINITI, no. 1, 1965; no. 2, 1966; no. 3, 1968; no. 4, 1970; no. 5, 1971; no. 6, 1972; no. 7, 1974; no. 8, 1978.
Emsley, J., The Elements, Oxford: Oxford Univ., 1992; Moscow: Mir, 1993.
Dahl, R.E., Beeler, L.R., and Bourquin, R.D., Computer simulation of extended defects in metals, Comput. Phys. Commun., 1971, vol. 2, pp. 301–321.
Orlov, A.N. and Trushin, Yu.V., Energii tochechnykh defektov (Energies of Point Defects), Moscow: Energoatomizdat, 1983.
Kar’kina, L.E. and Yakovenkova, L.I., Modelirovanie atomnoi struktury defektov v kristallakh. Nauchno-obrazovatel’naya seriya “Fizika kondensirovannykh sred” (Simulation of Defect Atomic Structure in Crystals. Scientific-Educational Series “Physics of Condensed Media”), Ekaterinburg: Ural. Otd. Ross. Akad. Nauk, vol. 5, 2011.
Damask, A.C. and Dins, G.J., Point Defects in Metals, New York: Gordon Breach, 1963; Moscow: Mir, 1966.