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1.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Sofronova S. N., Chernyshev A.
Заглавие : Magnetic ordering and the role of superexchange Ni–O–B–O–Ni upon the formation of magnetic order in ludwigite Ni2MnBO5 from first-principal calculations
Место публикации : Comput. Condens. Matter. - 2024. - Vol. 40. - Ст.e00918. - ISSN 23522143 (eISSN), DOI 10.1016/j.cocom.2024.e00918
Примечания : Cited References: 28
Аннотация: The energies of various magnetically ordered structures for ludwigite Ni2MnBO5 have been calculated in the framework of the first-principles approach using the Wien2K program package, with the parameters of exchange interactions being determined. Two subsystems can be distinguished in the magnetic system, which are associated with the triads 4-2-4 and 3-1-3. The magnetic moments of the ions in both triads are antiferromagnetically oriented. The analysis of the exchange contribution to the energy shows that there occurs an increase of the magnetic cell relative to the crystallographic one due to antiferromagnetic ordering of the magnetic moments along the c axis in three-legged ladders formed by 4-2-4 triads. However, in three-legged ladders formed by 3-1-3 triads, the magnetic moments of the ions are ordered along the c-axis ferromagnetically. The predicted type of magnetic ordering in Ni2MnBO5 is similar to magnetic ordering in Fe3BO5. Non-collinear ordering of the magnetic moments of the subsystems at different temperatures is also likely to be observed in Ni2MnBO5, as is the case in Fe3BO5. Superexchange (indirect) interactions (No-O-B-O-Ni) influence the orientation of the magnetic moments of two 3-1-3 (4-2-4) triads within the unit cell. It is these interactions that may be responsible for the formation of long-range magnetic order in Co3BO5 and ferrimagnetic-antiferromagnetic spin-reorientation transition in Fe3BO5.
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2.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Moshkina E. M., Eremin E. V., Veligzhanin, Alexey, Pavlovskiy M. S., Sofronova S. N., Titova, Veronika, Bezmaternykh L. N.
Заглавие : Concentration transition in Cu2(Mn,Ga)BO5 solid solutions
Колич.характеристики :13 с
Место публикации : J. Magn. Magn. Mater. - 2023. - Vol. 584. - Ст.171072. - ISSN 03048853 (ISSN), DOI 10.1016/j.jmmm.2023.171072. - ISSN 18734766 (eISSN)
Примечания : Cited References: 27
Аннотация: The effects related to the conversion of magnetic structures of a Cu2MnBO5 ferrimagnet to a Cu2GaBO5 antiferromagnet under the Mn3+ → Ga3+ substitution were studied. The properties of four single crystal samples with the gallium concentration x  = 0.04, 0.11, 0.17, 0.25 were examined. The chemical composition and valence state of the samples were determined by X-ray absorption spectroscopy element-sensitive technique. Distribution of the 3d metal ions over crystallographic positions was studied using the first principle calculations by Wien2k program. The evolution of the magnetic properties was investigated by the measurements of the temperature and field dependences of magnetization, dc and ac magnetic susceptibility. In agreement with the previous study of the structure evolution of Cu2Mn1-xGaxBO5 solid solutions, the critical concentration upon a change in the magnetic ordering type was found in the range x  = 0.17–0.25. The non-monotonic behavior of magnetization in terms of the gallium content was found in the concentration range of 0.04–0.17. A complex pattern of magnetic phase transitions belonging to the concentration phase boundary was obtained in the compounds with gallium being within the range x  = 0.17–0.25. One could observe the splitting of the peaks of the real part of ac-susceptibility of the high-temperature phase transition in the Cu2MnBO5-like phase (x = 0.04, 0.11) and that of the low-temperature one at the concentration boundary (x = 0.17, 0.25) with different frequency and orientational dependence. The type and origin of the multiple phase transitions observed in the studied samples were analyzed.
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3.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Moshkina E. M., Belskaya N. A., Molokeev M. S., Bovina A. F., Shabanova K. A., Kokh D., Seretkin Yu. V., Velikanov D. A., Eremin E. V., Krylov A. S., Bezmaternykh L. N.
Заглавие : Growth conditions and the structural and magnetic properties of Cu2MBO5 (M = Cr, Fe, Mn) oxyborates with a ludwigite structure
Коллективы : Eurasian Symposium “Trends in Magnetism”
Место публикации : J. Exp. Theor. Phys. - 2023. - Vol. 136, Is. 1. - P.17-25. - ISSN 10637761 (ISSN), DOI 10.1134/S1063776123010144. - ISSN 10906509 (eISSN)
Примечания : Cited References: 23. - The study was supported by the Russian Science Foundation (grant no. 22-12-20019) and Krasnoyarsk Regional Science Foundation
Аннотация: Copper oxyborate single crystals with a ludwigite structure, Cu2MBO5 (M = Cr, Fe, Mn), containing different substitutes in the trivalent subsystem have been grown from Bi2O3–MoO3–Na2O–B2O3 fluxes. The structural properties of grown compounds have been compared in detail using X-ray diffraction and Raman spectroscopy methods. In addition, these methods have been used to determine the degree of cationic ordering in these ludwigites. The temperature and field dependences of the Cu2MBO5 (M = Cr, Fe, Mn) ludwigite magnetization are presented.
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4.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Zamkova N. G., Zhandun V. S., Ovchinnikov S. G.
Заглавие : Magnetic structure and the spin-crossover mechanism in ludwigite Со3BO5
Колич.характеристики :7 с
Место публикации : JETP Lett. - 2023. - Vol. 118, Is. 5. - P.321-327. - ISSN 00213640 (ISSN), DOI 10.1134/S0021364023602555. - ISSN 10906487 (eISSN)
Примечания : Cited References: 18. - This work was supported by the Russian Science Foundation (no. 22-22-20024 https://rscf.ru/project/22-22-20024/) and the Krasnoyarsk Regional Science Foundation
Аннотация: A spin-crossover mechanism in ludwigite Со3BO5 is proposed on the basis of the DFT calculation with SCAN potentials. The role of separate exchange interactions in the establishment of the long-range magnetic order is demonstrated within the Monte Carlo method.
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5.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Moshkina E. M., Eremin E. V., Molokeev M. S., Kokh, Dieter, Krylov A. S.
Заглавие : Flux growth and Raman spectroscopy study of Cu2CrBO5 crystals
Колич.характеристики :15 с
Место публикации : Crystals. - 2023. - Vol. 13, Is. 10. - Ст.1415. - ISSN 20734352 (eISSN), DOI 10.3390/cryst13101415
Примечания : Cited References: 24. - The study was supported by a grant from the Russian Science Foundation and the Krasnoyarsk Regional Science Foundation No. 22-12-20019; https://rscf.ru/project/22-12-20019/
Аннотация: Multicomponent flux systems based on both Li2WO4-B2O3-Li2O-CuO-Cr2O3 and Bi2O3-MoO3-B2O3-Na2O-CuO-Cr2O3 were studied in order to grow Cu2CrBO5 crystals. The conditions for Cu2CrBO5 crystallization were investigated by varyingthe component ratios, and the peculiarities of their interaction were characterized by studying the formation sequence of high-temperature crystallizing phases. Special attention was paid to the problem of Cr2O3 solubility. Phase boundaries between CuCrO2, Cu2CrO4, and Cu2CrBO5 were considered. The crystal structure of the obtained samples was studied viasingle crystal and powder X-ray diffraction. The chemical composition of the grown crystals was examined using the EDX technique. Anactual ratio of Cu:Cr = 1.89:1.11 was found for Cu2CrBO5 grown from the lithium-tungstate system, which showed a small deviation from 2:1, implying the presence of a part of bivalent Cr2+ in the samples. Anomalies in the thermal dependence of magnetization were analyzed and compared with the previously obtained data for Cu2CrBO5. The anomaly at TC ≈ 42 K and the antiferromagnetic phase transition at TN ≈ 119 K were considered. Polarized Raman spectra of Cu2CrBO5 were obtained for the first time, and a comparative analysis of the obtained data with other monoclinic and orthorhombic ludwigites is presented. Along with the polarized room temperature spectra, the thermal evolution of Raman modes near the antiferromagnetic phase transition temperature TN ≈ 119 K is provided. The influence of the magnetic phase transition on the Raman spectra of Cu2CrBO5 is discussed.
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6.

Вид документа : Статья из сборника (однотомник)
Шифр издания :
Автор(ы) : Gokhfeld Yu. S., Solovyov L. A., Vereshchagin S. N., Borus A. A., Gudim I. A., Kazak N. V.
Заглавие : Thermal expansion and resistivity anomalies in Cu2FeBO5 ludwigite
Коллективы : Российская академия наук, Физико-технический институт им. Е.К. Завойского ФИЦ Казанского научного центра РАН, Казанский (Приволжский) федеральный университет, Euro-Asian Symposium "Trends in MAGnetism", "Trends in MAGnetism", Euro-Asian Symposium
Место публикации : VIII Euro-Asian symposium "Trends in magnetism" (EASTMAG-2022): Book of abstracts/ program com. S. G. Ovchinnikov [et al.]. - 2022. - Vol. 2, Sect. G: Frustrated and disordered magnetism. - Ст.G.P9. - P.27-28. - ISBN 978-5-94469-051-7
Примечания : Cited References: 5. - Support by RFBR 20-02-00559 and 21-52-12033 ННИО_а is acknowledged
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7.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Kazak N. V., Arauzo A., Bartolome J., Molokeev M. S., Dudnikov V. A., Solovyov L., Borus A., Ovchinnikov S. G.
Заглавие : Anisotropic thermal expansion and electronic transitions in the Co3BO5 ludwigite
Место публикации : Dalton Trans.: Royal Society of Chemistry, 2022. - Vol. 51, Is. 16. - С. 6345-6357. - ISSN 14779226 (ISSN), DOI 10.1039/d2dt00270a
Примечания : Cited References: 57. - We are grateful to the Russian Foundation for Basic Research (project no. 20-02-00559 and 21-52-12033) for supporting this paper. This work was performed within the framework of the budget project no. 0287-2021-0013 for the Institute of Chemistry and Chemical Technology SB RAS. We acknowledge the financial support from the Spanish Ministry of Economy, Industry and Competitiviness (MINECO), (Grant No. MAT2017-83468-R) and from the regional Government of Aragón (E12-20R RASMIA project)
Аннотация: The investigations of the crystal structure, magnetic and electronic properties of Co3BO5 at high temperatures were carried out using powder X-ray diffraction, magnetic susceptibility, electrical resistivity, and thermopower measurements. The orthorhombic symmetry (Sp.gr. Pbam) was observed at 300 K and no evidence of structural phase transitions was found up to 1000 K. The compound shows a strong anisotropy of the thermal expansion. A large negative thermal expansion along the a-axis is observed over a wide temperature range (T = 300–600 K) with αa = −35 M K−1 at T = 500 K with simultaneous expansion along the b- and c-axes with αb = 70 M K−1 and αc = 110 M K−1, respectively. The mechanisms of thermal expansion are explored by structural analysis. The activation energy of the conductivity decreases significantly above 700 K. Electronic transport was found to be a dominant conduction mechanism in the entire temperature range. The correlations between the thermal expansion, electrical resistivity, and effective magnetic moment were revealed and attributed to the evolution of the spin state of Co3+ ions towards the spin crossover and gradual charge-ordering transition.
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8.

Вид документа : Статья из сборника (однотомник)
Шифр издания :
Автор(ы) : Gokhfeld Yu. S., Kazak N. V., Molokeev M. S., Dudnikov V. A., Solovyov L. A., Ovchinnikov S. G.
Заглавие : Anisotropic thermal expansion in Co3BO5 ludwigite
Коллективы : Российская академия наук, Физико-технический институт им. Е.К. Завойского ФИЦ Казанского научного центра РАН, Казанский (Приволжский) федеральный университет, Euro-Asian Symposium "Trends in MAGnetism", "Trends in MAGnetism", Euro-Asian Symposium
Место публикации : VIII Euro-Asian symposium "Trends in magnetism" (EASTMAG-2022): Book of abstracts/ program com. S. G. Ovchinnikov [et al.]. - 2022. - Vol. 2, Sect. H: Magnetism of strongly correlated electron systems. - Ст.H.P6. - P.87-88. - ISBN 978-5-94469-051-7
Примечания : Cited References: 3. - Support by RFBR 20-02-00559 and 21-52-12033 ННИО_а is acknowledged
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9.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Sofronova S. N., Eremin E. V., Moshkina E. M., Selyanina A. V., Bondarenko G. N., Shabanov A. V.
Заглавие : Synthesis, structural and magnetic properties of ludwigite Mn1.32Ni0.85Cu0.83BO5
Место публикации : Phys. Solid State. - 2022. - Vol. 64, Is. 11. - P.1743-1749. - ISSN 10637834 (ISSN), DOI 10.21883/PSS.2022.11.54200.425. - ISSN 10906460 (eISSN)
Примечания : Cited References: 19. - The study was done with financial support from the Russian Foundation for Basic Research, Government of Krasnoyarsk Territory and the Krasnoyarsk Regional Fund of Science within scientific project No. 20-42-240011. The research was carried out using the equipment provided by the Krasnoyarsk Regional Center for Collective Use
Аннотация: Single crystals of Mn1.32Ni0.85Cu0.83BO5 with the ludwigite structure were obtained by the solution-melt method during spontaneous crystallization. The concentration of copper, manganese and nickel ions was determined by transmission microscopy. Manganese ions are included in compounds in the divalent and trivalent states. The study of temperature and field dependences showed that we have several magnetic transitions. The first transition, associated with the ferrimagnetic ordering of the magnetic moments of parts of the ions, observed in the region of 50 K. In the region of 25 K, a second magnetic transition is observed. Substitution of nickel ions for copper and divalent manganese of better disorder and competition of exchange interactions, which leads to the division of the magnetic system into several magnetic subsystems that are ordered at different temperatures.
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10.

Вид документа : Статья из сборника (однотомник)
Шифр издания :
Автор(ы) : Popov D. V., Gavrilova T. P., Yatsyk I. V, Cherosov M. A., Moshkina E. M., Shustov V. A., Eremina R. M.
Заглавие : Magnetic and temperature properties of ludwigite Mn1.17CO1.83BO5
Коллективы : Российская академия наук, Физико-технический институт им. Е.К. Завойского ФИЦ Казанского научного центра РАН, Казанский (Приволжский) федеральный университет, Euro-Asian Symposium "Trends in MAGnetism", "Trends in MAGnetism", Euro-Asian Symposium
Место публикации : VIII Euro-Asian symposium "Trends in magnetism" (EASTMAG-2022): Book of abstracts/ program com. S. G. Ovchinnikov [et al.]. - 2022. - Vol. 1, Sect.: Low dimensional magnetism. - Ст.C.P1. - P.346-347. - ISBN 978-5-94469-051-7
Примечания : Cited References: 3. - Electron spin resonance measurements were performed with the financial support from the government assignment for FRC Kazan Scientific Center of RAS
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