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Вид документа : Статья из сборника (однотомник)
Шифр издания :
Автор(ы) : Ovchinnikov S. G., Gavrichkov V. A., Polukeev S. I., Malakhovskii A. V.
Заглавие : Exchange interaction between excited states of magnetic ions
Коллективы : Российская академия наук, Уральское отделение РАН, Институт физики металлов им. М. Н. Михеева Уральского отделения РАН, Уральский федеральный университет им. первого Президента России Б.Н. Ельцина, Российский фонд фундаментальных исследований, Euro-Asian Symposium "Trends in MAGnetism", "Trends in MAGnetism", Euro-Asian Symposium
Место публикации : Euro-asian symposium "Trends in magnetism" (EASTMAG-2019): Book of abstracts/ чл. конс. ком.: S. G. Ovchinnikov, N. V. Volkov [et al.] ; чл. прогр. ком. D. M. Dzebisashvili [et al.]. - 2019. - Vol. 2. - Ст.H.I1. - P.36-37. - ISBN 978-5-9500855-7-4 (Шифр В33/E12-125657784)
Примечания : Cited References: 8. - Support by RSF grant 18-12-00022 is acknowledged
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Ovchinnikov S. G., Gavrichkov V. A., Polukeev S. I., Malakhovskii A. V.
Заглавие : Exchange Interaction between the Excited States of Magnetic Ions
Место публикации : Phys. Metals Metallogr. - 2019. - Vol. 120, Is. 13. - P.91-94. - ISSN 0031-918X (ISSN), DOI 10.1134/S0031918X19130210. - ISSN 1555-6190 (eISSN)
Примечания : Cited References: 11. - This work was supported by the Russian Science Foundation, project no. 18-12-00022.
Аннотация: Within the framework of the LDA + GTB multi-electron approach to the electron structure of Mott–Hubbard insulators a scheme is developed for constructing the effective low-energy Hamiltonian that includes not only the ground state of the magnetic cation, but also the excited terms. The mathematical apparatus of the theory are Hubbard operators built on the many-electron states of the cation in the dn configuration. The occupation of the excited term under optical pumping can change the sign of the exchange interaction of the excited cation with the neighboring cation in the ground state. Another variant of the occupation of the excited states is connected with a spin crossover when the excited and the ground terms change over, for example, at high pressure. Examples are given for such crystals as FeBO3, Nd0.5Gd0.5Fe3(BO3)4 and NiO.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Gavrichkov V. A., Polukeev S. I., Ovchinnikov S. G.
Заглавие : Cation spin and superexchange interaction in oxide materials below and above spin crossover under high pressure [Electronic resource]
Место публикации : ArXiv. - 2019. - Ст.1911.06482
Вид и объем ресурса: Electronic text data
Примечания : Cited References: 63. - We acknowledge the support of the Russian Science Foundation through Grant 18-12-00022.
Предметные рубрики: Materials Science
Strongly Correlated Electrons
Аннотация: We derived simple rules for the sign of superexchange interaction based on the multielectron calculations of the superexchange interaction in the transition metal oxides that are valid both below and above spin crossover under high pressure. The superexchange interaction between two cations in dn configurations is given by a sum of individual contributions related to the electron-hole virtual excitations to the different states of the dn+1 and dn−1 configurations. Using these rules, we have analyzed the sign of the superexchange interaction of a number of oxides with magnetic cations in electron configurations from d2 till d8: the iron, cobalt, chromium, nickel, copper and manganese oxides with increasing pressure. The most interesting result concerns the magnetic state of cobalt and nickel oxides CoO, Ni2O3 and also La2CoO4, LaNiO3 isostructural to well-known high-TC and colossal magnetoresistance materials. These oxides have a spin 12 at the high pressure. Change of the interaction from antiferromagnetic below spin crossover to ferromagnetic above spin crossover is predicted for oxide materials with cations in d5(FeBO3) and d7(CoO) configurations, while for materials with the other dn configurations spin crossover under high pressure does not change the sign of the superexchange interaction.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Gavrichkov V. A., Polukeev S. I., Ovchinnikov S. G.
Заглавие : Cation spin and superexchange interaction in oxide materials below and above spin crossover under high pressure
Коллективы : Russian Science FoundationRussian Science Foundation (RSF) [18-12-00022]
Место публикации : Phys. Rev. B. - 2020. - Vol. 101, Is. 9. - Ст.094409. - ISSN 2469-9950, DOI 10.1103/PhysRevB.101.094409. - ISSN 2469-9969(eISSN)
Примечания : Cited References: 65. - We acknowledge the support of the Russian Science Foundation through Grant No. 18-12-00022
Предметные рубрики: EXCHANGE INTERACTION
PHASE-TRANSITIONS
STATE
ELECTRON
IRON
Аннотация: We derived simple rules for the sign of 180° superexchange interaction based on the multielectron calculations of the superexchange interaction in the transition metal oxides that are valid both below and above spin crossover under high pressure. The superexchange interaction between two cations in dn configurations is given by a sum of partial contributions related to the electron-hole virtual excitations to the different states of the dn+1 and dn−1 configurations. Using these rules, we have analyzed the sign of the 180° superexchange interaction of a number of oxides with magnetic cations in electron configurations from d2 until d8: the iron, cobalt, chromium, nickel, copper, and manganese oxides with increasing pressure. The most interesting result concerns the magnetic state of cobalt and nickel oxides CoO, Ni2O3 and also La2CoO4, LaNiO3 isostructural to well-known high-TC and colossal magnetoresistance materials. These oxides have a spin 12 at the high pressure. Change of the interaction from antiferromagnetic below spin crossover to ferromagnetic above spin crossover is predicted for oxide materials with cations in d5(FeBO3) and d7(CoO) configurations, while for materials with the other dn configurations spin crossover under high pressure does not change the sign of the 180∘ superexchange interaction.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Gavrichkov V. A., Polukeev S. I., Ovchinnikov S. G.
Заглавие : Contribution from optically excited many-electron states to the superexchange interaction in Mott-Hubbard insulators
Место публикации : Phys. Rev. B: American Physical Society, 2017. - Vol. 95, Is. 14. - Ст.144424. - ISSN 10980121 (ISSN), DOI 10.1103/PhysRevB.95.144424
Примечания : Cited References: 49. - This work was supported by the Russian Foundation for Basic Research, Government of Krasnoyarsk Territory and Krasnoyarsk Region Science and Technology Support Fund to the research Project No. 17-42-240212. We are also grateful to the RFBR Grants No. 16-02-00273, No. 16-02-00098, and No. NSh-7559.2016.2.
Аннотация: We investigated the effects of excited many-electron states in the optical control of the magnetic state in undoped Mott-Hubbard insulator. To derive the spin Hamiltonian in material under optical pumping one has used a many-electron approach based on the X-operator representation. Extending the projection operators approach on arbitrary energy spectra of the Mott-Hubbard insulator, we obtained the Hamiltonian of superexchange interaction in analytical form. The Hamiltonian includes the spin-exciton variables which are usually missing in discussion on the magnetic response to optical pumping. The superexchange is also not additive over contributions from the ground and optical excited states, and nonzero contributions to the Dzyaloshinskii-Moriya interaction are induced in insulators with different spins at the ground and excited cell states. As a test, a microscopic background for the optical induced superexchange was analyzed in La2CuO4 (further La214) and FeBO3 with spins 1/2 and 5/2, respectively. © 2017 American Physical Society.
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Вид документа : Статья из сборника (однотомник)
Шифр издания :
Автор(ы) : Gavrichkov V. A., Polukeev S. I., Ovchinnikov S. G.
Заглавие : Exchange interaction under optical pumping and ultrahigh pressure in magnetic insulators
Коллективы : "Functional materials", International conference, Крымский федеральный университет имени В.И. Вернадского
Место публикации : Ovchinnikov S. G. International conference "Functional materials": book of abstracts/ ed. V. N. Berzhansky ; org. com. S. G. Ovchinnikov [et al.]. - Simferopol, 2021. - P.10
Примечания : Библиогр.: 6 назв. - We are thankful to the RSF for a financial support under the project No. 18-12-00022 P
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Gavrichkov V. A., Polukeev S. I.
Заглавие : Lattice source for charge and spin inhomogeneity in 2D perovskite cuprates
Колич.характеристики :5 с
Место публикации : Phys. B: Condens. Matter. - 2024. - Vol. 673. - Ст.415457. - ISSN 09214526, DOI 10.1016/j.physb.2023.415457. - ISSN 18732135
Примечания : Cited References: 31. - We acknowledge the support of the Russian Science Foundation through grant RSF No. 22-22-00298
Аннотация: In the work we highlight the structural features of 2D perovskite cuprates (tilted CuO6 octahedra with different orientation with respect to spacer rocksalt layers), where sources of charge and spin inhomogeneity can be hidden. We used the impurity Anderson model with the Jahn–Teller(JT) local cells to show the charge inhomogeneity arises at any low doping concentration x, but disappears when the doping level exceeds threshold concentration xc, and the smaller the magnitudes xc, the larger the area of regions with JT pseudo effect. It is expected that spontaneous chiral symmetry breaking in the dynamic JT state of the stripe CuO2 layer as a whole can lead to the appearance of the goldstone phonon mode. As consequence, the giant thermal Hall effect could be observed in the 2D perovskite cuprates with CuO6 octahedra, rather than with CuO4 squares, e.g. in the Tl-based n layer cuprates or cuprates based on infinite-layer CaCuO2 structure.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Gavrichkov V. A., Polukeev S. I.
Заглавие : Magnetic interaction in doped 2D perovskite cuprates with nanoscale inhomogeneity: Lattice nonlocal effects vs. superexchange
Место публикации : Condens. Matter. - 2022. - Vol. 7, Is. 4. - Ст.57. - ISSN 24103896, DOI 10.3390/condmat7040057
Примечания : Cited References: 78. - This work was supported by the Russian Science Foundation, research grant RSF No.22-22-00298
Аннотация: We have studied the superexchange interaction Jij in doped 2D cuprates. The AFM interaction strongly depends on the state of the lattice of a CuO2 layer surrounded by two LaO rock salt layers. In a static U and D stripe nanostructure, the homogeneous AFM interaction is impossible due to the U/D/U… periodic stripe sequence and TN=0. In a dynamic stripe nanostructure, the ideal CuO2 layer with nonlocal effects and the homogeneous AFM interaction are restored. However, the interaction Jij decreases by the exponential factor due to partial dynamic quenching. The meaning of the transition from the dynamic to the static cases lies in the spontaneous θ-symmetry breaking with respect to the rotation of all the tilted CuO6 octahedra by an orientation angle δθ=n⋅(45°) (where n=1÷4) in the U and D stripe nanostructure of the CuO2 layer. Moreover, the structural features help to study various experimental data on the charge inhomogeneity, Fermi level pinning in the p type cuprates only and time reversal symmetry breaking from a unified point of view.
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Вид документа : Статья из сборника (однотомник)
Шифр издания :
Автор(ы) : Gavrichkov V. A., Polukeev S. I.
Заглавие : Magnetic interaction in doped 2D perovskites with nanoscale inhomogenety: lattice nonlocal effects vs superexchange
Коллективы : "Сильно коррелированные электронные системы и квантовые критические явления", конференция, Российская академия наук, Физический институт им. П.Н. Лебедева РАН
Место публикации : XIX Конференция "Сильно коррелированные электронные системы и квантовые критические явления": сборник тезисов/ чл. прогр. ком. С. Г. Овчинников и др. - Москва, 2022. - P.194-196. - ISBN 978-5-4344-0954-4
Примечания : Библиогр.: 1
,
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10.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Gavrichkov V. A., Polukeev S. I., Ovchinnikov S. G.
Заглавие : Superexchange interaction in magnetic insulators with spin crossover
Место публикации : J. Exp. Theor. Phys. - 2018. - Vol. 127, Is. 4. - P.713-720. - ISSN 10637761 (ISSN), DOI 10.1134/S1063776118100023
Примечания : Cited References: 34. - This work was supported by the Russian Science Foundation (project no. 18-12-00022).
Ключевые слова (''Своб.индексиров.''): antiferromagnetism--ground state--high pressure engineering--ions--iron compounds--magnetic materials
Аннотация: We present the derivation of a microscopic superexchange Hamiltonian for undoped magnetic insulators with an arbitrary spin. It is established that the sign of the (ferromagnetic or antiferromagnetic) superexchange between magnetic ions in the dn configuration depends on the spin nature of virtual multielectron states dn± 1, viz., low-spin or high-spin partners with S ± 1/2 relative to ground state of the dn configuration with spin S. A macroscopic substantiation is given for the Goodenough–Kanamori rules and simple mean-field estimates connecting the magnetic ordering temperature with the exchange constant. The conventional Anderson superexchange for magnetic materials with spin S = 1/2 and the P/T magnetic phase diagram for ferroborate FeBO3 with spin crossover S = (5/2 ↔ 1/2) at the Fe3+ ion under a high pressure are also reproduced as a test.
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