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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Zinenko V. I., Zamkova N. G.
Заглавие : Ab initio calculation of the ferroelectric phase transition in disordered and ordered PbSc0.5Ta0.5O3 and PbSc0.5Nd0.5O3 solid solutions with the use of a model Hamiltonian
Разночтения заглавия :авие SCOPUS: Ab initio calculation of the ferroelectric phase transition in disordered and ordered PbSc0.5Ta0.5O3 and PbSc 0.5Nd0.5O3 solid solutions with the use of a model Hamiltonian
Место публикации : J. Exp. Theor. Phys.: MAIK NAUKA/INTERPERIODICA/SPRINGER, 2008. - Vol. 106, Is. 3. - P542-549. - ISSN 1063-7761, DOI 10.1134/S1063776108030138
Примечания : Cited References: 17
Предметные рубрики: RELAXOR FERROELECTRICS
PEROVSKITES
BATIO3
PBTIO3
Ключевые слова (''Своб.индексиров.''): approximation theory--ferroelectric materials--hamiltonians--mathematical models--monte carlo methods--phase transitions--ferroelectric phase transition--gordon-kim model--local-mode approximation--solid solutions
Аннотация: To describe the ferroelectric phase transition in ordered and disordered PbSc0.5Ta0.5O3 (PST) and PbSc0.5Nd0.5O3 (PSN) solid solutions, a model Hamiltonian is written in the local-mode approximation, in which long-range dipole-dipole and short-range interactions of local modes are taken into account. The Hamiltonian parameters are determined from the set of energies of a series of distorted structures, calculated within the nonempirical generalized Gordon-Kim model. The statistical mechanics of the systems with a model Hamiltonian is investigated by the Monte Carlo method. It is revealed that PSN solid solutions undergo a transition to the ferroelectric rhombohedral phase through an intermediate phase, existing in a narrow temperature range. PST solid solutions undergo a ferroelectric phase transition directly from the paraelectric cubic to the ferroelectric rhombohedral phase.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Iskhakov R. S., Kuzovnikova L. A., Komogortsev S. V., Denisova E. A., Balaev A. D., Mal'tsev V. K., Bondarenko G. N.
Заглавие : Accelerated mechanical alloying of mutually insoluble metals: Co-Cu system
Место публикации : Tech. Phys. Lett.: AMER INST PHYSICS, 2004. - Vol. 30, Is. 1. - P60-63. - ISSN 1063-7850, DOI 10.1134/1.1646717
Примечания : Cited References: 11
Предметные рубрики: SOLID-SOLUTIONS
P ALLOYS
POWDERS
Аннотация: We propose a new method for accelerating the process of mechanical alloying in the Co-Cu system possessing positive enthalpy of mixing and exhibiting no mutual solubility of components under equilibrium conditions. For this purpose, highly disperse powders of composite particles representing a Co-P amorphous alloy core covered with a nanocrystalline copper shell were prepared by chemical deposition. These composite powders were mechanically alloyed by processing in a ball mill. Investigation of the atomic structure and magnetic properties of the composite powders upon milling showed that the formation of supersaturated Co-Cu solid solutions under such conditions requires a much shorter milling time as compared to that for the conventional mechanical alloying processes. (C) 2004 MAIK "Nauka / Interperiodica".
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Ivanova N. B., Kazak N. V., Markov V. V., Ovchinnikov S. G., Rudenko V. V., Abd-Elmeguid M. M.
Заглавие : Analysis of the electrical and optical properties of VBO3 single crystals and Fe1-xVxBO3 solid solutions on the basis of a many-electron model of energy band structure
Место публикации : Phys. Solid State: AMER INST PHYSICS, 2004. - Vol. 46, Is. 8. - P1462-1468. - ISSN 1063-7834, DOI 10.1134/1.1788779
Примечания : Cited References: 32. - One of the authors (M.M.A.) would like to thank the Deutsche Forschungsgemeinschaft (SFB608) for financial support. This study was supported by the Russian Foundation for Basic Research (project no. 03-02-16286), the program "Integration" (project no. B0017), and the program of the Division of Physical Sciences of the Russian Academy of Sciences "Strongly Correlated Electrons"
Предметные рубрики: MAGNETIC-PROPERTIES
CALCITE STRUCTURE
PHASE-TRANSITION
FERRIC BORATE
HIGH-PRESSURE
FEBO3
FE1-XCRXBO3
FERROMAGNET
MOSSBAUER
SPECTRA
Аннотация: A many-electron model of the energy band structure of VBO3 and of Fe1 - xVxBO3 solid solutions is proposed with strong electron correlations taken into account. Experimental optical absorption spectra and data on the resistivity are discussed in the framework of the suggested model. Variation in the magnetic and electronic properties of VBO3 and Fe1 - xVxBO3 under high pressure is predicted. For VBO3, a Mott-Hubbard (insulator-metal) transition is expected in the high-pressure phase. In Fe1 - xVxBO3 solid solutions, a nontrivial variation in the properties is predicted, leading to the appearance of a different magnetic state. (C) 2004 MAIK "Nauka / Interperiodica".
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Bormanis K., Gorev M. V., Flerov I. N., Sternberg A., Lace L., Ignatans R., Kalvane A., Antonova M.
Заглавие : Behaviour of thermal expansion of (1-x)Pb(Ni1/3Nb2/3)O3-xPbTiO3 solid solutions
Место публикации : Proc. Est. Acad. Sci. - 2017. - Vol. 66, Is. 4. - P.363-371. - ISSN 17366046 (ISSN), DOI 10.3176/proc.2017.4.09
Примечания : Cited References: 25. - The publication costs of this article were covered by the Estonian Academy of Sciences and the University of Tartu.
Ключевые слова (''Своб.индексиров.''): ferroelectrics--relaxors--ceramics--solid solutions--thermal expansion--phase diagram
Аннотация: The features of the dependence of the bulk coefficient of thermal expansion of the (1-x)Pb(Ni1/3Nb2/3)O3-xPbTiO3 solid solution studied in the series of x = 0-0.8 in the temperature range from 100 to 750 K are reported. The obtained data and observed anomalies of thermal expansion are compared with dielectric properties, heat capacity, and the phase diagram of concentration. The anomalous and lattice constituents of deformation and of the coefficient of thermal expansion are analysed and the data on deformation are used to estimate the Burns temperature and the mean square polarization of the samples found to decrease with the decrease of the PbTiO3 concentration.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Zhandun V. S., Zinenko V. I.
Заглавие : Calculations of the lattice dynamics and spontaneous polarization for thin ferroelectric films of disordered solid solutions PbB'(1/2) BaEuro(1/2)(3)O(3) (B' = Sc, Ga, In, Lu; BaEuro(3) = Nb, Ta)
Коллективы : Russian Foundation for Basic Research; President of the Russian Federation [NSh-4137.2006.2]
Место публикации : Phys. Solid State. - 2009. - Vol. 51, Is. 9. - P.1894-1900. - ISSN 1063-7834, DOI 10.1134/S1063783409090212
Примечания : Cited References: 13. - This study was supported by the Russian Foundation for Basic Research and the Council on Grants from the President of the Russian Federation for Support of the Leading Scientific Schools of the Russian Federation (grant no. NSh-4137.2006.2).
Аннотация: The lattice dynamics and spontaneous polarization in thin ferroelectric films of disordered solid solutions PbB'(1/2) BaEuro(1/2)(3) O-3 (B' = Sc, Ga, In, Lu; BaEuro(3) = Nb, Ta) are calculated in terms of the generalized Gordon-Kim model. It is found that all the compounds under investigation contain an unstable polar mode, the frequencies of this mode for all the compounds are close in magnitude, and the eigenvectors of the soft polar mode are different in character for different types of surfaces (PbO and aOE (c) B O-2, where aOE (c) B is the average ion in the virtual crystal approximation). The frequency of the soft polar mode, the dynamic Born charges, and the rf permittivity are calculated as functions of the film thickness. It is demonstrated that, as the film thickness increases, all the above quantities tend to corresponding values for the bulk compound. The spontaneous polarization of the monoclinic phase distorted along the eigenvector of the soft mode is calculated as a function of the film thickness and in individual layers of the film for different types of surfaces.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Mikhaleva E. A., Flerov I. N., Gorev M. V., Molokeev M. S., Cherepakhin A. V., Kartashev A. V., Mikhashenok N. V., Sablina K. A.
Заглавие : Caloric characteristics of PbTiO3 in the temperature range of the ferroelectric phase transition
Место публикации : Phys. Solid State: MAIK Nauka-Interperiodica / Springer, 2012. - Vol. 54, Is. 9. - P.1832-1840. - ISSN 1063-7834, DOI 10.1134/S1063783412090181
Примечания : Cited References: 31. - This study was supported by the Russian Foundation for Basic Research (project no. 12-08-00079) and the Council on Grants from the President of the Russian Federation for Support of Leading Scientific Schools of the Russian Federation (grant no. NSh-4828.2012.2).
Предметные рубрики: SINGLE-CRYSTALS
LEAD TITANATE
DIELECTRIC PROPERTIES
SOLID-SOLUTIONS
PRESSURE
PEROVSKITES
DEPENDENCE
BEHAVIOR
HEAT
Аннотация: The heat capacity and thermal expansion of the PbTiO3 ceramic sample have been measured in the temperature range 80–970 K. The electrocaloric and barocaloric efficiencies of lead titanate in the ferroelectric phase transition range have been investigated by analyzing the experimental data in terms of the thermodynamic theory of phase transitions, the electrical equation of state P(T, E), the Pippard equation, and the S(T, p) diagram.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Aleksandrova I.P., Ivanov Yu.N., Bondarev V.S., Sukhovskiy A.A., Voronov V.N.
Заглавие : Calorimetric and 23Na MAS NMR Study of the Phase Diagram of NaNb1-xTaxO3 Solid Solutions
Место публикации : Functional mate rials. - 2010. - Vol. 17. - С. 18-24
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Aleksandrova I. P., Ivanov Y. N., Bondarev V. S., Sukhovskii A. A., Voronov V. N.
Заглавие : Calorimetric and 23Na MAS NMR study of the phase diagram of NANB1_xTAxO3 solid solutions
Место публикации : Functional Materials. - 2010. - Vol. 17, Is. 1. - P.18-23. - ISSN 1027-5495
Аннотация: The heat capacity of NaNb1_xTaxO3 solid solutions was measured in the temperature range 100 to 770 K. The step-like change of phase transition temperature is observed in the T-x phase diagram at concentration x = 0.55. The obtained results are in a good agreement with the data of dielectric studies. The 23Na MAS NMR spectra were obtained at Larmor frequency 79.35 MHz using a Bruker AVANCE 300 spectrometer. The quadru-polar coupling constant, (CQ=e2qQ/h) and asymmetry parameter (n) were determined by computer fitting of the NMR line shape using the DMFit software. The found parameters show that solid solution structure is NaTa03-based at 0.7<X ?1 and NaNbO3-based at 0?x?0.5. The spectra in the intermediate region (0.5<x?0.7) can be described at a reasonable accuracy when assuming the coexistence of NaTaO3 and NaNbO3 structures. В© 2010 - STC "Institute for Single Crystals".
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Вид документа : Статья из сборника (однотомник)
Шифр издания :
Автор(ы) : Romanova O. B., Aplesnin S. S., Galyas A. I., Yanushkevich K. I., Sokolov V. V.
Заглавие : Cation-substituted TmXMn1-XS solid solutions with special magnetic and electrical properties
Коллективы : International Conference on Magnetism
Место публикации : 20th Int. Conf. on Magnetism (ICM-2015): book of abstracts. - 2015. - P.241
Предметные рубрики: Semiconductor spintronics
Материалы конференции
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10.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Vorobyev S., Likhatski M., Romanchenko A., Maksimov N., Zharkov S. M., Krylov A. S., Mikhlin Y.
Заглавие : Colloidal and deposited products of the interaction of tetrachloroauric acid with hydrogen selenide and hydrogen sulfide in aqueous solutions
Место публикации : Minerals. - 2018. - Vol. 8, Is. 11. - Ст.492. - ISSN 2075163X (ISSN), DOI 10.3390/min8110492
Примечания : Cited References: 63. - This research was funded by the Siberian Branch of the Russian Academy of sciences, Program of Interdisciplinary Studies, grant number 64 (project 303).
Ключевые слова (''Своб.индексиров.''): gold selenide--gold sulfoselenide--colloids--nanoparticles--nucleation--liquid intermediates--deposition
Аннотация: The reactions of aqueous gold complexes with H2Se and H2S are important for transportation and deposition of gold in nature and for synthesis of AuSe-based nanomaterials but are scantily understood. Here, we explored species formed at different proportions of HAuCl4, H2Se and H2S at room temperature using in situ UV-vis spectroscopy, dynamic light scattering (DLS), zeta-potential measurement and ex situ Transmission electron microscopy (TEM), electron diffraction, X-ray diffraction (XRD), X-ray photoelectron spectroscopy (XPS), and Raman spectroscopy. Metal gold colloids arose at the molar ratios H2Se(H2S)/HAuCl4 less than 2. At higher ratios, pre-nucleation “dense liquid” species having the hydrodynamic diameter of 20–40 nm, zeta potential −40 mV to −50 mV, and the indirect band gap less than 1 eV derived from the UV-vis spectra grow into submicrometer droplets over several hours, followed by fractional nucleation in the interior and coagulation of disordered gold chalcogenide. XPS found only one Au+ site (Au 4f7/2 at 85.4 eV) in deposited AuSe, surface layers of which partially decomposed yielding Au0 nanoparticles capped with elemental selenium. The liquid species became less dense, the gap approached 2 eV, and gold chalcogenide destabilized towards the decomposition with increasing H2S content. Therefore, the reactions proceed via the non-classical mechanism involving “dense droplets” of supersaturated solution and produce AuSe1−xSx/Au nanocomposites.
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