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ZEIN, N. E.
ABINITIO CALCULATIONS OF PHONON FREQUENCIES AND DIELECTRIC-CONSTANTS IN A(4)B(6) COMPOUNDS / N. E. ZEIN, V. I. ZINENKO, A. S. FEDOROV // Phys. Lett. A. - 1992. - Vol. 164, Is. 1. - P. 115-119, DOI 10.1016/0375-9601(92)90916-A. - Cited References: 20 . - ISSN 0375-9601

РУБ Physics, Multidisciplinary
Рубрики:
IV-VI COMPOUNDS
CRYSTAL-STRUCTURE
Аннотация: The transverse and longitudinal optical frequencies at q = 0, the dielectric constant and the effective charges are calculated for the A4B6 type family of the semiconducting compounds GeTe, SnTe and PdTe. The calculations are performed in the framework of the density functional method with the use of the norm-conserving "first-principles" pseudopotentials. The estimated ferroelectric phase transition temperatures and a number of other calculated quantities turned out to be in good agreement with the experimental data. The variations of the electronic structure in the row PbTe-GeTe, which promote the ferroelectric phase transition for GeTe, are discussed.

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Держатели документа:
LV KIRENSKY PHYS INST,KRASNOYARSK 660036,USSR
ИФ СО РАН

Доп.точки доступа:
ZINENKO, V. I.; Зиненко, Виктор Иванович; FEDOROV, A. S.; Федоров, Александр Семенович
}
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Unusual sequence of phase transitions in (NH4)3TiF7 detected by optic and calorimetric studies / S. V. Mel'nikova [et al.] // J. Fluor. Chem. - 2014. - Vol. 165. - P. 14-19, DOI 10.1016/j.jfluchem.2014.05.016. - Cited References: 13. - This work was supported by Russian Foundation for Basic Research (Grant no. 12-02-00056), and the Council on Grants from the President of the Russian Federation for the Support of Leading Scientific Schools of the Russian Federation (Grant no. NSh-924.2014.2). . - ISSN 0022-1139. - ISSN 1873-3328

РУБ Chemistry, Inorganic & Nuclear + Chemistry, Organic
Рубрики:
CRYSTAL-STRUCTURE
DIFFRACTION
NH4F
Кл.слова (ненормированные):
Cubic fluorides -- Phase transitions -- Crystal-optic -- Calorimetry
Аннотация: For the first time structural transformations were observed for one of the compounds belonging to the family of double salt fluorides A3MeF7 = A2MeF6·AF. Single crystals of (NH4)3TiF7 = (NH4)2TiF6·NH4F were grown by evaporation of the aqueous solution. Polarizing optical observations, heat capacity and birefringence Δn = (no − ne) measurements were performed in a wide temperature range 100–400 K. Two reversible, first order structural phase transitions were found to be followed by an unusual sequence of symmetry changes: cubic (G3) (T2↓ = 287.5 K; T2↑ = 291–310 K) ↔ P4/mnc (G2) (T1↓ = 358.5 K; T1↑ = 360 K) ↔ 4/m (G1). The twin structures observed were described assuming the existence of cubic parent phase G0 with P m 3 ¯ m symmetry.

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Держатели документа:
RAS, LV Kirensky Phys Inst, Siberian Dept, Krasnoyarsk 660036, Russia
Siberian Fed Univ, Krasnoyarsk 660074, Russia
Russian Acad Sci, Inst Chem, Far Eastern Dept, Vladivostok 690022, Russia

Доп.точки доступа:
Mel'nikova, S. V.; Мельникова, Светлана Владимировна; Pogoreltsev, E. I.; Погорельцев, Евгений Ильич; Flerov, I. N.; Флёров, Игорь Николаевич; Laptash, N. M.; Russian Foundation for Basic Research [12-02-00056]; Council on Grants from the President of the Russian Federation for the Support of Leading Scientific Schools of the Russian Federation [NSh-924.2014.2]
}
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Uniaxial magnetic anisotropy in Co2.25Fe0.75O2BO3 compared to Co3O2BO3 and Fe3O2BO ludwigites / J. . Bartolome [et al.] // Phys. Rev. B. - 2011. - Vol. 83, Is. 14. - Ст. 144426, DOI 10.1103/PhysRevB.83.144426. - Cited References: 25. - The authors acknowledge V. V. Rudenko for the oxyborate samples they made and O. A. Bayukov for fruitful discussion. The financial support of Spanish MINCYT, Grant No. MAT08/1077, and the Aragonese E-34 project are acknowledged. Fruitful discussions with F. Bartolome and P. Bordet are acknowledged. The latter is thanked for providing the FeINF3/INFOINF2/INFBOINF3/INF single crystal. Also this study was supported by the Russian Foundation for Basic Research (Project No. 09-02-00171-a), the Federal Agency for Science and Innovation (Rosnauka) (Project No. MK-5632.2010.2), and the Physical Division of the Russian Academy of Science (Program "Strongly Correlated Electrons," Project No. 2.3.1). . - ISSN 1098-0121

РУБ Physics, Condensed Matter
Рубрики:
CRYSTAL-STRUCTURE
MOSSBAUER
CO3BO5
Аннотация: Magnetic and Mossbauer spectroscopy (MS) measurements have been performed on a single crystal of Co2.25Fe0.75O2BO3 with ludwigite structure. Two magnetic transitions (T-N = 115 K and T-C = 70 K) were traced from the ac susceptibility temperature dependence. The MS spectra as a function of temperature clearly show the onset of magnetic ordering below 115 K. Magnetization measurements on the parent Co3O2BO3 and Fe3O2BO3 compounds have been done for comparison. In Fe3O2BO3 the anisotropy of the different phases has been determined, showing that the anisotropy axis changes from the a to the b axis in the low-temperature antiferromagnetic phase. High magnetic uniaxial anisotropy has been detected for both Co3O2BO3 and Co2.25Fe0.75O2BO3. From the angle-dependent magnetization measurements it is found that in both compounds the easy axis of magnetization is the b [010] axis, where an antiferromagnetic component is superimposed on the main ferromagnetic component. In the c direction the behavior is purely antiferromagnetic. In Co2.25Fe0.75O2BO3 a strong reduction of the remanent magnetization and a very strong increase in coercive field along the b axis with respect to those found in Co3O2BO3 were observed from magnetic hysteresis cycles measured below T-C. The increase of coercive field is caused by the increase of defects upon Co substitution by Fe.

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Держатели документа:
[Bartolome, J.] Univ Zaragoza, CSIC, Inst Ciencia Mat Aragon, E-50009 Zaragoza, Spain
[Bartolome, J.] Univ Zaragoza, CSIC, Dept Fis Mat Condensada, E-50009 Zaragoza, Spain
[Arauzo, A.] Univ Zaragoza, Serv Instrumentac Cientif, Area Medidas Fis, E-50009 Zaragoza, Spain
[Kazak, N. V.
Ovchinnikov, S. G.] RAS, SB, LV Kirensky Phys Inst, Krasnoyarsk 660036, Russia
[Ivanova, N. B.
Knyazev, Yu. V.] Siberian Fed Univ, Krasnoyarsk 660074, Russia
[Ivanova, N. B.] Krasnoyarsk State Agrarian Univ, Krasnoyarsk, Russia
[Ovchinnikov, S. G.] Siberian State Aerosp Univ, Krasnoyarsk, Russia
[Lyubutin, I. S.] RAS, AV Shubnikov Crystallog Inst, Moscow 119333, Russia
ИФ СО РАН
Instituto de Ciencia de Materiales de Aragon, Departamento de Fisica de la Materia Condensada, CSIC-Universidad de Zaragoza, 50009 Zaragoza, Spain
Servicio de Instrumentacion Cientifica, Area de Medidas Fisicas, Universidad de Zaragoza, Pedro Cerbuna 12, 50009 Zaragoza, Spain
L.V. Kirensky Institute of Physics, SB of RAS, 660036, Akademgorodok, Krasnoyarsk, Russian Federation
Siberian Federal University, Kirensky street 26, 660074, Krasnoyarsk, Russian Federation
Krasnoyarsk State Agrarian University, Mira street 90, Krasnoyarsk, Russian Federation
Siberian State Aerospace University, Krasnoyarskiy Rabochiy street 31, Krasnoyarsk, Russian Federation
Shubnikov Institute of Crystallography, RAS, Leninskiy prospect 59, 119333, Moscow, Russian Federation

Доп.точки доступа:
Bartolome, J.; Arauzo, A.; Kazak, N. V.; Казак, Наталья Валерьевна; Ivanova, N. B.; Иванова, Наталья Борисовна; Ovchinnikov, S. G.; Овчинников, Сергей Геннадьевич; Knyazev, Yu. V.; Князев, Юрий Владимирович; Lyubutin, I. S.
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Thermal expansion, phase diagrams and barocaloric effects in (NH4)(2)NbOF5 / M. . Gorev [et al.] // J. Phys.: Condens. Matter. - 2010. - Vol. 22, Is. 18. - Ст. 185901, DOI 10.1088/0953-8984/22/18/185901. - Cited References: 17. - This work was supported in part by the Krasnoyarsk Regional Foundation for Support of Scientific and Scientific-Technological Investigations and RFBR in the framework of project 'Siberia' (Grant No. 09-02-98001), and the Council on Grants from the President of the Russian Federation for Support of Leading Scientific Schools (project No. Nsh-1011.2008.2). . - ISSN 0953-8984

РУБ Physics, Condensed Matter
Рубрики:
CRYSTAL-STRUCTURE
   SOLID-STATE
   OXYFLUORIDE
   TRANSITION
   ANION
Кл.слова (ненормированные):
Antiferromagnets -- Ferromagnets -- Heat capacities -- High stress -- Intermediate phase -- Pippard relations -- Structural phase transition -- Transition temperature -- Uniaxial pressures -- Financial data processing -- Phase diagrams -- Phase transitions -- Thermal stress -- Tools -- Thermal expansion
Аннотация: The thermal expansion along the a, b and c axes of a (NH4)(2)NbOF5 crystal was measured from 120 to 300 K. Anomalies of alpha(T) associated with previously reported phase transitions Cmc2(1) -> C-2 -> I a were observed along all directions at T-1 = 259.3 K and T-2 = 220.5 K. The analysis of thermal expansion and heat capacity in the frame of the Pippard relations has permitted us to determine the uniaxial pressure derivatives of the transition temperatures dT/d sigma(i). The T-sigma(i) phase diagrams have shown a tendency for the intermediate phase to disappear at high stress along the b and c axes. Intensive and extensive barocaloric effects near the structural phase transitions were found to be comparable with the caloric parameters of some ferroelectrics, ferromagnets and antiferromagnets.

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Держатели документа:
[Gorev, Michail
Bogdanov, Evgeny
Flerov, Igor] Russian Acad Sci, Siberian Div, LV Kirensky Phys Inst, Krasnoyarsk 660036, Russia
[Gorev, Michail
Flerov, Igor] Siberian Fed Univ, Inst Engn Phys, Krasnoyarsk 660041, Russia
[Laptash, Nataly] Russian Acad Sci, Far Eastern Div, Inst Chem, Vladivostok 690022, Russia
ИФ СО РАН
LVKirensky Institute of Physics, Siberian Division, Russian Academy of Sciences, Krasnoyarsk, Akademgorodok 660036, Russian Federation
Institute of Engineering Physics, Siberian Federal University, av. Svobodny 79, Krasnoyarsk 660041, Russian Federation
Institute of Chemistry, Far Eastern Division, Russian Academy of Sciences, Vladivostok 690022, Russian Federation

Доп.точки доступа:
Gorev, M.; Bogdanov, E. V.; Богданов, Евгений Витальевич; Flerov, I. N.; Флёров, Игорь Николаевич; Laptash, N. M.
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    The trigonal polymorph of strontium tetraborate, beta-SrB4O7 [Text] / A. D. Vasiliev, A. V. Cherepakhin, A. I. Zaitsev // Acta Crystallogr. Sect. E.-Struct Rep. Online. - 2010. - Vol. 66, Part 6. - PI48-U132, DOI 10.1107/S1600536810019069. - Cited Reference Count: 22. - Гранты: We thank the State Program for Support of Leading Scientific Schools (grant LS-4645.2010.2.). - Финансирующая организация: Leading Scientific Schools [LS-4645.2010.2] . - JUN. - ISSN 1600-5368
Рубрики:
CRYSTAL-STRUCTURE
   SRB4O7
   LUMINESCENCE
   MODEL
Кл.слова (ненормированные):
Tetra
Аннотация: The asymmetric unit of the title compound, beta-SrB4O7, contains five Sr atoms (three located on a threefold rotation axis), twelve B and 21 O atoms. The structure is made up from BO3 triangles and BO4 tetrahedra in a 1:1 ratio. Pairs of BO3 triangles are linked to BO4 tetrahedra via common corners, forming chains. These chains are further linked to adjacent chains through corner-sharing, leading to a three-dimensional framework with channels running parallel to [001]. The Sr2+ ions reside in the channels and exhibit strongly distorted polyhedra The density of the beta-polymorph is considerably lower than that of beta-SrB4O7, which is constructed solely from BO4 tetrahedra.

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Держатели документа:
Inst Phys SB RAS, Krasnoyarsk 660036, Russia
Siberian Fed Univ, Krasnoyarsk 660041, Russia

Доп.точки доступа:
Vasiliev, Alexander D.; Cherepakhin, Alexander V.; Zaitsev, Alexander I.
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    The cis-trans isomer transformation, spectroscopic and thermal properties of Li, Na, K 1,3-diethyl-2-thiobarbiturate complexes / N. N. Golovnev [et al.] // Polyhedron. - 2015. - Vol. 85. - P. 493-498, DOI 10.1016/j.poly.2014.09.011. - Cited References:42. - The study has been carried out within the public task of the Ministry ofEducation and Science of the Russian Federation for research engineeringat the Siberian Federal University in 2014. V.V.A. is partly supportedby the Ministry of Education and Science of the Russian Federation. . - ISSN 0277-5387
   Перевод заглавия: Трансформация цис-транс изомеров, спектроскопические и термические свойства Li, Na, K 1,3-диэтил-2-тиобарбитуратных комплексов

РУБ Chemistry, Inorganic & Nuclear + Crystallography
Рубрики:
CRYSTAL-STRUCTURE
   2-THIOBARBITURIC ACID
   STRUCTURAL-CHARACTERIZATION
   HYDROGEN-BOND
   DIFFRACTION
   THIOBARBITURATE
   CHEMISTRY
   NETWORKS
   SPECTRA
   SERIES
Кл.слова (ненормированные):
1,3-Diethyl-2-thiobarbituric acid -- Alkali ions -- X-ray diffraction -- Infrared spectroscopy -- Thermal analysis
Аннотация: Three new complexes of 1,3-diethyl-2-thiobarbituric acid (C8H11N2O2S, HDETBA) with Li+, Na+, K+ alkali ions were synthesized. The complexes have been prepared by neutralization of 1,3-diethyl-2-thiobarbituric acid with the corresponding metal hydroxide in aqueous solution. The colorless crystals have been investigated using X-ray single crystal and powder techniques and characterized by differential scanning calorimetry, thermogravimetry and infrared spectroscopy. The compounds of MDETBA with M = Li and M = Na crystallize in the monoclinic lattice with a = 10.678(1) Å, b = 7.2687(9) Å, c = 13.202(2) Å, β = 108.841(2)°, Z = 4, V = 969.8(2) Å3, S.G. P21/n and a = 10.534(2) Å, b = 7.604(1) Å, c = 14.186(1) Å, β = 108.964(4)°, Z = 4, V = 1074.6(3) Å3, S.G. P21/n, respectively. Сompound KDETBA crystallizes in the orthorhombic lattice with a = 4.2541(6) Å, b = 14.739(2) Å, c = 16.635(3) Å, Z = 4, V = 1043.1(3) Å3, S.G. P212121. In Li(I) and Na(I) complexes, the DETBA− ion is in cis-configuration and, in the K(I) complex, this ion is in trans-configuration. The reason for the transformation from cis- to trans-configuration has been rationalized.

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Держатели документа:
Siberian Fed Univ, Dept Chem, Krasnoyarsk 660041, Russia
SB RAS, Kirensky Inst Phys, Lab Crystal Phys, Krasnoyarsk 660036, Russia
SB RAS, Inst Chem & Chem Technol, Lab Catalyt Convers Small Mol, Krasnoyarsk 660036, Russia
SB RAS, Irkutsk Favorsky Inst Chem, Phys Chem Lab, Irkutsk 664033, Russia
Inst Semicond Phys, Lab Opt Mat & Struct, Novosibirsk 630090, Russia
Tomsk State Univ, Funct Elect Lab, Tomsk 634050, Russia
Novosibirsk State Univ, Lab Semicond & Dielect Mat, Novosibirsk 630090, Russia

Доп.точки доступа:
Golovnev, N. N.; Molokeev, M. S.; Молокеев, Максим Сергеевич; Vereshchagin, Sergey N.; Sterkhova, I. V.; Atuchin, V. V.; Ministry of Education and Science of the Russian Federation
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    Thallium ionic conductivity of new thallium indium hafnium molybdate ceramics / V. G. Grossman, J. G. Bazarova, M. S. Molokeev, B. G. Bazarov // Ionics. - 2020. - Vol. 26. - P. 6157-6165, DOI 10.1007/s11581-020-03739-7. - Cited References: 60. - This study was carried out within the state assignment of FASO of Russia (Theme No 0339-2016-0007) as well was supported by RFBR Grants 18-08-00799 and 18-03-00557 . - ISSN 0947-7047. - ISSN 1862-0760
   Перевод заглавия: Таллий-ионная проводимость новой керамики на основе таллия, индия, гафния, молибдата

РУБ Chemistry, Physical + Electrochemistry + Physics, Condensed Matter
Рубрики:
POSITIVE ELECTRODE MATERIAL
CRYSTAL-STRUCTURE
TRIPLE MOLYBDATE
Кл.слова (ненормированные):
Synthesis -- Thallium -- Molybdates -- Phase diagram -- DSC -- Conducting material
Аннотация: In the process of studying the system Tl2MoO4–In2(MoO4)3–Hf(MoO4)2, a new thallium indium hafnium molybdate was found. The crystal structure of the molybdate Tl5InHf(MoO4)6 was determined in the centrosymmetric space group R3¯c (a = 10.63893 (5) Å, c = 38.1447(3) Å; V = 3739.04 (4) Å3, Z = 6). The structure is a three-dimensional framework consisting of alternating (Hf,In)O6-octahedra connected by МоО4-tetrahedra. Each octahedron has common vertices with tetrahedra. The atoms arranged in this way form channels extended along with the a and b axes, in which thallium atoms are located. The conductivity behavior of Tl5InHf(MoO4)6 ceramics was studied in the temperature range from 300 to 870 K. The conductivity of the heavy cations of thallium is activated with increasing temperature.

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Держатели документа:
Russian Acad Sci, Baikal Inst Nat Management, Siberian Branch, Sakhyanovoy St 6, Ulan Ude 670047, Buryat Republic, Russia.
Russian Acad Sci, Fed Res Ctr KSC, Kirensky Inst Phys, Siberian Branch, 50-38 Akademgorodok, Krasnoyarsk 660036, Russia.
Siberian Fed Univ, 82 Svobodniy Av, Krasnoyarsk 660041, Russia.

Доп.точки доступа:
Grossman, Victoria G.; Bazarova, J. G.; Molokeev, M. S.; Молокеев, Максим Сергеевич; Bazarov, B. G.; RFBRRussian Foundation for Basic Research (RFBR) [0339-2016-0007]; [18-08-00799]; [18-03-00557]
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Synthesis, structure, and thermophysical properties of EuGaGe2O7 / L. T. Denisova, M. S. Molokeev, L. A. Irtyugo [et al.] // Inorg. Mater. - 2020. - Vol. 56, Is. 8. - P. 854-858, DOI 10.1134/S002016852008004X. - Cited References: 18 . - ISSN 0020-1685. - ISSN 1608-3172

РУБ Materials Science, Multidisciplinary
Рубрики:
TEMPERATURE HEAT-CAPACITY
THERMODYNAMIC PROPERTIES
CRYSTAL-STRUCTURE
Кл.слова (ненормированные):
europium gallium germanate -- solid-state synthesis -- differential scanning calorimetry -- heat capacity -- structure -- thermodynamic properties
Аннотация: The europium gallium germanate EuGaGe2O7 has been prepared by solid-state reaction in air in the temperature range 1273–1473 K using a stoichiometric mixture of Eu2O3, Ga2O3, and GeO2. Its crystal structure has been determined by X-ray diffraction (sp. gr. P21/c, a = 7.1693(7) Å, b = 6.57008(6) Å, c = 12.7699(1) Å, β = 117.4522(5)°, V = 533.768(8) Å3). The heat capacity of polycrystalline samples has been determined by differential scanning calorimetry in the temperature range 350–1053 K and the experimental data have been used to calculate the thermodynamic properties (enthalpy increment, entropy change, and reduced Gibbs energy change) of EuGaGe2O7.

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Публикация на русском языке Синтез, структура и теплофизические свойства EuGaGe2O7 [Текст] / Л. Т. Денисова, М. С. Молокеев, Л. А. Иртюго [и др.] // Неорган. матер. - 2020. - Т. 56 № 8. - С. 901-905

Держатели документа:
Siberian Fed Univ, Inst Nonferrous Met & Mat Sci, Svobodnyi Pr 79, Krasnoyarsk 660041, Russia.
Russian Acad Sci, Siberian Branch, Fed Res Ctr, Kirensky Inst Phys,Krasnoyarsk Sci Ctr, Akademgorodok 50-38, Krasnoyarsk 660036, Russia.
Siberian Fed Univ, Inst Engn Phys & Radio Elect, Ul Akad Kirenskogo 28-12 B, Krasnoyarsk 660041, Russia.
Russian Acad Sci, Baikov Inst Met & Mat Sci, Leninskii Pr 49, Moscow 119991, Russia.

Доп.точки доступа:
Denisova, L. T.; Molokeev, M. S.; Молокеев, Максим Сергеевич; Irtyugo, L. A.; Beletskii, V. V.; Kargin, Yu. F.; Denisov, V. M.
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Synthesis, structure, and properties of EuLnCuSe3 (Ln = Nd, Sm, Gd, Er) / O. V. Andreev, V. V. Atuchin, A. S. Aleksandrovsky [et al.] // Crystals. - 2022. - Vol. 12, Is. 1. - Ст. 17, DOI 10.3390/cryst12010017. - Cited References: 60. - The study was funded by the Ministry of Science and Higher Education of the Russian Ferderation (Projects AAAA-A21-121011390011-4 and AAAA-A19-119031890025-9), as well as the Government of the Tyumen Region (grant to non-profit organizations No. 2. 89-don, dated 7 December 2020) . - ISSN 2073-4352

РУБ Crystallography + Materials Science, Multidisciplinary
Рубрики:
RARE-EARTH
   CRYSTAL-STRUCTURE
   MAGNETIC-PROPERTIES
   CHALCOGENIDES
Кл.слова (ненормированные):
rare earth elements -- complex sulfides -- chalcogenides -- crystal structure -- magnetic properties
Аннотация: EuLnCuSe3 (Ln = Nd, Sm, Gd, Er), due to their complex composition, should be considered new materials with the ability to purposefully change the properties. Samples of the EuLnCuSe3 were prepared using Cu, rare earth metal, Se (99.99%) by the ampoule method. The samples were obtained by the crystallization from a melt and annealed at temperatures 1073 and 1273 K. The EuErCuSe3 crystal structure was established using the single-crystal particle. EuErCuSe3 crystallizes in the orthorhombic system, space group Cmcm, KCuZrS3 structure type, with cell parameters a = 4.0555 (3), b = 13.3570 (9), and c = 10.4602 (7) Å, V = 566.62 (6) Å3. In structure EuErCuSe3, erbium ions are coordinated by selenium ions in the octahedral polyhedron, copper ions are in the tetrahedral coordination, europium ions are between copper and erbium polyhedra layers and are coordinated by selenium ions as two-cap trigonal prisms. The optical band gap is 1.79 eV. At 4.7 K, a transition from the ferrimagnetic state to the paramagnetic state was detected in EuErCuSe3. At 85 and 293 K, the compound is in a paramagnetic state. According to XRPD data, EuLnCuSe3 (Ln = Nd, Sm, Gd) compounds have a Pnma orthorhombic space group of the Eu2CuS3 structure type. For EuSmCuSe3, a = 10.75704 (15) Å, b = 4.11120 (5) Å, c = 13.37778 (22) Å. In the series of EuLnCuSe3 compounds, the optical band gap increases 1.58 eV (Nd), 1.58 eV (Sm), 1.72 eV (Gd), 1.79 eV (Er), the microhardness of the 205 (Nd), 210 (Sm), 225 (Gd) 235 ± 4 HV (Er) phases increases, and the thermal stability of the phases increases significantly. According to the measurement data of differential scanning calorimetry, the EuNdCuSe3 decomposes, according to the solid-phase reaction T = 1296 K, ΔH = 8.2 ± 0.8 kJ/mol. EuSmCuSe3 melts incongruently T = 1449 K, ΔH = 18.8 ± 1.9 kJ/mol. For the EuGdCuSe3, two (Tα↔β = 1494 K, ΔHα↔β = 14.8 kJ/mol, Tβ↔γ = 1530 K, ΔHβ↔γ = 4.8 kJ/mol) and for EuErCuSe3 three polymorphic transitions (Tα↔β = 1561 K, ΔHα↔β = 30.3 kJ/mol, Tβ↔γ = 1579 K, ΔHβ↔γ = 4.4 kJ/mol, and Tγ↔δ = 1600 K, ΔHγ↔δ = 10.1 kJ/mol). The compounds melt incongruently at the temperature of 1588 K, ΔHmelt = 17.9 ± 1.8 kJ/mol and 1664 K, ΔHmelt = 25.6 ± 2.5 kJ/mol, respectively. Incongruent melting of the phases proceeds with the formation of a solid solution of EuSe and a liquid phase.

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Держатели документа:
Univ Tyumen, Inst Chem, Tyumen 625003, Russia.
RAS, Inst Semicond Phys, Lab Opt Mat & Struct, SB, Novosibirsk 630090, Russia.
Kemerovo State Univ, Res & Dev Dept, Kemerovo 650000, Russia.
Novosibirsk State Tech Univ, Dept Ind Machinery Design, Novosibirsk 630073, Russia.
RAS, KSC, Fed Res Ctr, Kirensky Inst Phys,SB, Krasnoyarsk 660036, Russia.
Siberian Fed Univ, Dept Photon & Laser Technol, Krasnoyarsk 660036, Russia.
Ind Univ Tyumen, Dept Gen & Special Chem, Tyumen 625000, Russia.
RAS, Boreskov Inst Catalysis, SB, Novosibirsk 630090, Russia.
Novosibirsk State Univ, Lab Mol Design & Ecol Safe Technol, Novosibirsk 630090, Russia.
RAS, Inst Solid State Chem, UB, Ekaterinburg 620990, Russia.

Доп.точки доступа:
Andreev, O. V.; Atuchin, V. V.; Aleksandrovsky, A. S.; Александровский, Александр Сергеевич; Denisenko, Y. G.; Zakharov, B. A.; Tyutyunnik, A. P.; Habibullayev, N. N.; Velikanov, D. A.; Великанов, Дмитрий Анатольевич; Ulybin, D. A.; Shpindyuk, D. D.; Ministry of Science and Higher Education of the Russian Ferderation [AAAA-A21-121011390011-4, AAAA-A19-119031890025-9]; Government of the Tyumen Region [2. 89-don]
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10.

    Synthesis, structure and properties of K2(1-x)Rb2xAl2B2O7 and Cs1.39Tl0.61Al2B2O7 borates as the basis for preparing new oxide materials / V. G. Grossman [et al.] // Lett. Mater. - 2019. - Vol. 9, Is. 1. - P. 86-90 ; Письма о материалах, DOI 10.22226/2410-3535-2019-1-86-90. - Cited References:22. - The research was carried out within the state assignment of FASO of Russia (Theme No 0339-2016-0007). . - ISSN 2218-5046. - ISSN 2410-3535
   Перевод заглавия: Синтез, структура и свойства боратов K2(1-x)Rb2xAl2B2O7 и Cs1.39Tl0.61Al2B2O7 как основа получения новых оксидных материалов

РУБ Materials Science, Multidisciplinary
Рубрики:
OPTICAL-PROPERTIES
   CRYSTAL-STRUCTURE
   K2Al2B2O7
   GROWTH
Кл.слова (ненормированные):
borate -- solid-phase synthesis -- optical properties -- борат -- твердофазный синтез -- оптические свойства
Аннотация: With the development of technology, the need for highly efficient functional materials is steadily increasing. Currently, borates attract the attention of researchers, as they are promising nonlinear materials. Potassium rubidium aluminum borate based on potassium aluminum borate (trigonal syngony, space group P321, Z = 3) was obtained by solid-phase synthesis. The individuality and purity of the borates were confirmed by X-ray diffraction. Analysis of differential scanning calorimetry and thermogravimetric method for K2(1‑x)Rb2xAl2B2O7 (x = 0.1– 0.8) was performed in the temperature range of 25–1075°С. Potassium rubidium borates decompose in the temperature range of 900 –1000°C. Differential scanning calorimetry, dielectric loss tangent, and second-harmonic generation data revealed phase transitions for K0.6Rb1.4Al2B2O7. A significant SHG effect was found at room temperature for K0.6Rb1.4Al2B2O7 (Q = 70). Then the SHG effect increases to Q = 85 at a temperature of 645°C and remains constant with a further increase in temperature. The new triple borate Cs1.39Tl0.61Al2B2O7 was synthesized by the solid-phase synthesis, and its crystallographic parameters were obtained by the Rietveld method. This borate crystallizes in the monoclinic space group P21 / c with the unit cell parameters: Z = 2, a = 6.6669(3) Å, b = 7.2991(3) Å , c = 9.3589(4) Å , β =116.6795(18)°, V = 406.94(3) Å 3. The structure can be considered to be built up from the nearly planar [Al2B2O10] rings, which are composed of two AlO4 tetrahedra and two BO3 triangles, connected, alternately to each other by corner-sharing.
С развитием технологии потребность в высокоэффективных функциональных материалах растет. В настоящее время бораты привлекают внимание исследователей, поскольку они являются перспективными нелинейными материалами. Твердофазным синтезом получены бораты K2(1-x)Rb2xAl2B2O7 (x = 0.1–0.8) на основе калий-алюминиевого бората (тригональная сингония, пространственная группа P321, Z = 3). Индивидуальность и чистота боратов подтверждена рентгеновской дифракцией. Анализ дифференциально-сканирующей калориметрией и термогравиметрическим методом для K2(1-x)Rb2xAl2B2O7 (x = 0.1–0.8) был проведен в интервале температур 25–1075 ºС. Калий-рубидиевые бораты разлагаются в интервале температур 900–1000 °C. Дифференциальной сканирующей калориметрией, диэлектрическими измерениями и методом генерации второй оптической гармоники выявлены фазовые переходы для K0.6Rb1.4Al2B2O7. Значительный ГВГ-эффект был обнаружен при комнатной температуре для K0.6Rb1.4Al2B2O7 (Q = 70). Эффект генерации второй гармоники возрастает до Q = 85 при температуре 645 °C и остается постоянным при дальнейшем увеличении температуры. Новый тройной борат Cs1.39Tl0.61Al2B2O7 был синтезирован методом твердофазного синтеза, а его кристаллографические параметры были получены с помощью метода Ритвельда. Этот борат кристаллизуется в моноклинной пространственной группе P21/c с параметрами элементарной ячейки: Z = 2, a = 6.6669 (3) Å, b = 7.2991 (3) Å, c = 9.3589 (4) Å, β = 116.6795 (18)º, V = 406.94 (3) Å3. Структуру можно представить в виде почти плоских колец [Al2B2O10], которые состоят из двух тетраэдров AlO4 и двух BO3 треугольников, соединенных попеременно друг с другом посредством вершин.

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Держатели документа:
RAS, Baikal Inst Nat Management, Siberian Branch, 6 Sakhyanova St, Ulan Ude 670047, Russia.
Lomonosov Moscow State Univ, GSP 1,1-3 Leninskie Gory, Moscow 119991, Russia.
RAS, Siberian Branch, Kirensky Inst Phys, Fed Res Ctr KSC, 50-38 Akademgorodok, Krasnoyarsk 660036, Russia.
Siberian Fed Univ, 82 Svobodniy Av, Krasnoyarsk 660041, Russia.

Доп.точки доступа:
Grossman, V. G.; Гроссман В. Г.; Bazarov, B. G.; Базаров Б. Г.; Stefanovich, S. Y.; Стефанович С. Ю.; Molokeev, M. S.; Молокеев, Максим Сергеевич; Bazarova, J. G.; Базарова Ж. Г.; [0339-2016-0007]

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