Abstract
By quantum chemistry, the behavior of hydrogen in pure aluminum was described, and the key energy characteristics of a system consisting of hydrogen atoms in a periodic aluminum crystal were calculated.
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REFERENCES
Grushko, O., Ovsyannikov, B., and Ovchinnikov, V., Alumnium–Lithium Alloys, Process Metallurgy, Physical Metallurgy, and Welding, Boca Raton, FL: CRS Press/Taylor & Francis Group, 2017.
Zolotarevsky, V.S., Belov, N.A., and Glazoff, M.V., Casting Aluminum Alloys, Amsterdam: Elsevier, 2007.
Verners, O., Psofogiannakis, G., and van Duin, A.C.T., Corros. Sci., 2015, vol. 98, pp. 40–49.
Kukushkin, S.A., J. Appl. Phys., 2005, vol. 98, p. 033503.
Indeitsev, D.A. and Osipova, E.V., Dokl. Akad. Nauk, 2011, vol. 440, pp. 472–475.
Indeitsev, D.A. and Osipova, E.V., Dokl. Akad. Nauk, 2013, vol. 449, no. 3, pp. 286–289.
Indeitsev, D.A., Osipova, E.V., and Polyanskii, V.A., Dokl. Akad. Nauk, 2014, vol. 459, no. 3, pp. 294–297.
Tsuneda, T., Density Functional Theory in Quantum Chemistry, Tokyo: Springer, 2014.
Cheremskoi, P.G., Slezov, V.V., and Betekhtin, V.I., Pory v tverdom tele (Pores in Solids), Moscow: Energoatomizdat, 1990.
Lee, J.G., Computational Materials Science. An Introduction, Boca Raton, FL: CRS Press/Taylor & Francis Group, 2017.
Giannozzi, P., Baroni, S., Bonini, N., et al., J. Phys.: Condens. Matter, 2009, vol. 21, p. 395502.
Wimmer, E., Wolf, W., Sticht, J., Saxe, P., Geller, C.B., Najafabadi, R., and Young, G.A., Phys. Rev., 2008, vol. 77, p. 134305.
Henkelman, G. and Jonsson, H., J. Chem. Phys., 2000, vol. 113, pp. 9901–9904.
Young, G.A., Jr. and Scully, J.R., Acta Mater., 1998, vol. 46, p. 6337.
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Indeitsev, D.A., Osipova, E.V. Formation of Surface Hydrogen Layer in Pure Aluminum. Dokl Phys Chem 484, 4–7 (2019). https://doi.org/10.1134/S0012501619010020
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DOI: https://doi.org/10.1134/S0012501619010020