The projector augmented-waves method within the density functional theory was used to perform a systematic study of the atomic and electronic structure of three phases (α, β, and α'') of titanium doped with V, Nb, and Mo depending on the impurity concentration. The features of the electronic structure caused by impurity elements are determined. The critical impurity concentrations at which structural transformations occur are established. A correlation between the critical impurity concentration and the density of valence electrons is revealed. It is shown that the β-stabilizing effect of vanadium is more pronounced than that of niobium, but weaker than that of Mo. The obtained tendencies agree well with the available experimental results.
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References
C. Leyens and M. Peters, Titanium and Titanium Alloys. Fundamentals and Applications, WILEY-VCH, Weinheim (2003).
K. M. Rajan, K. S. Ashok, C. R. Bharat, et al., Mater. Today: Proc., 62, 3865–3868 (2022).
S. V. Razorenov, G. V. Garkushin, A. S. Savinykh, et al., Fiz. Mezomekh., 24, No. 3, 17–25 (2021).
V. E. Gyunter, V. V. Kotenko, M. Z. Mirgazizov, et al., Alloys with Shape Memory in Medicine [in Russian], Izd. Tomskogo Univers., Tomsk (1986).
F. H. Froes and M. Qian, Titanium in Medical and Dental Applications, Woodhead Publishing, Cambridge (2018).
E. S. Fisher and C. J. Renken, Phys. Rev., 135, No. 2A, A482–A494 (1964).
T. Ando, K. Nakashima, T. Tsuchiyama, et al., Mater. Sci. Eng. A, 486, No. 1–2, 228–234 (2008).
H. Y. Kim and S. Miyazaki, Mater. Trans., 56, No. 5, 625–634 (2015).
R. Dong, H. Kou, L. Wu, et al., J. Mater. Sci., 56, 1685–1693 (2021).
M. Niinomi, J. Mech. Behav. Biomed. Mater., 1, 30–42 (2008).
T. Ozaki, H. Matsumoto, S. Watanabe, et al., Mater. Trans., 45, No. 8, 2776–2779 (2004).
E. S. Marchenko, G. A. Baigonakova, and A. A. Klopotov, Izv. Vyssh. Uchebn. Zaved. Fiz., 57, No. 6/2, 68–74 (2014).
A. Panin, A. Dmitriev, A. Nikonov, et al., Metals, 12, 732-1–16 (2022).
N. Skripnyak, A. V. Ponomareva, M. P. Belov, and I. Abrikosov, Mater. Des., 140, 357−365 (2018).
A. Shugurov, A. Panin, M. Kazachenok, et al., Metals, 11, 1882-1–12 (2021).
V. E. Egorushkin and S. E. Kulkova, J. Phys. F: Met. Phys., 12, 2823–2828 (1982).
Ch. E. Lekka, J. J. Gutiérrez-Moreno, and M. Calin, J. Phys. Chem. Solids, 102, 49–61 (2017).
P. E. Blöchl, Phys. Rev. B, 50, 17953–17979 (1994).
G. Kresse and D. Joubert, Phys. Rev. B, 59, 1758–1775 (1999).
J. P. Perdew, K. Burke, and M. Ernzerhof, Phys. Rev. Lett., 77, 3865–3868 (1996).
R. M. Wood, Proc. Phys. Soc., 80, 783–786 (1962).
O. N. Senkov, B. C. Chakoumakos, J. J. Jonas, et al., Mater. Res. Bull., 36, 1431–1440 (2001).
O. B. Perevalova and A. V. Panin, Fiz. Khim. Obrab. Met., 6, 50–62 (2017).
B. Thaddeus, Binary Alloys Phase Diagrams, V. 2, American Society for Metals, Metals Park, Ohio (1987).
R. P. Kolli, W. J. Joost, and S. Ankem, JOM, 67, 1273–1280 (2015).
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Translated from Izvestiya Vysshikh Uchebnykh Zavedenii, Fizika, No. 8, pp. 42–48, August, 2022.
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Kasparyan, S.O., Bakulin, A.V. & Kulkova, S.E. Effect of V, Nb, and Mo Impurities on the Stability of Titanium Phases. Russ Phys J 65, 1283–1289 (2022). https://doi.org/10.1007/s11182-023-02763-0
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DOI: https://doi.org/10.1007/s11182-023-02763-0