Abstract
Complex studies of magnetic, electrical, and optical properties of Vx Fe1−x BO3 solid solutions are carried out in the entire range of concentrations between the extreme compounds VBO3 and FeBO3. A concentration semiconductor-insulator transition accompanied by a change in the magnetic structure is observed. It is found that the physical properties of the solid solution under investigation differ from those predicted in the model of a virtual crystal in the form of an aggregate of V and Fe centers taken with the weight of x and 1−x, respectively. The systems of electron energy levels of the VB6O6 and FeB6O6 clusters are calculated from first principles using the Hartree-Fock method. The calculated electron structure forms the basis for simulating the optical absorption spectra, which are in good agreement with experimental results. A qualitative explanation is given for the entire body of data on electrical conductivity and magnetization.
Similar content being viewed by others
References
T. A. Bither, C. G. Frederick, T. E. Gier, et al., Solid State Commun. 8, 109 (1970).
H. Schmid, Acta Crystallogr. 17, 1080 (1964).
B. Andlauer, J. Schneider, and W. Wettling, Appl. Phys. 10, 189 (1976).
O. Müller, M. P. O’Horo, and J. F. O’Neill, J. Solid State Chem. 23, 115 (1978).
M. P. O’Horo and O. Müller, J. Appl. Phys. 49, 1516 (1978).
N. F. Mott, Metal-Insulator Transitions (Taylor & Francis, London, 1974; Nauka, Moscow, 1979).
V. N. Zabluda, A. V. Malakhovskoii, and I. S. Édel’man, Fiz. Tverd. Tela (Leningrad) 27, 133 (1985) [Sov. Phys. Solid State 27, 77 (1985)].
B. Andlauer, O. F. Schirmen, and J. Schneider, Solid State Commun. 13, 1655 (1973).
M. W. Schmidt, K. K. Balridge, J. A. Boats, et al., J. Comput. Chem. 14, 1347 (1993).
Author information
Authors and Affiliations
Additional information
__________
Translated from Zhurnal Éksperimental’no\(\overset{\lower0.5em\hbox{$\smash{\scriptscriptstyle\smile}$}}{l}\) i Teoretichesko\(\overset{\lower0.5em\hbox{$\smash{\scriptscriptstyle\smile}$}}{l}\) Fiziki, Vol. 121, No. 2, 2002, pp. 354–362.
Original Russian Text Copyright © 2002 by Ivanova, Rudenko, Balaev, Kazak, Markov, Ovchinnikov, Edel’man, Fedorov, Avramov.
Rights and permissions
About this article
Cite this article
Ivanova, N.B., Rudenko, V.V., Balaev, A.D. et al. Magnetic, optical, and electrical properties of solid solutions VxFe1−x BO3 . J. Exp. Theor. Phys. 94, 299–306 (2002). https://doi.org/10.1134/1.1458479
Received:
Issue Date:
DOI: https://doi.org/10.1134/1.1458479