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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Denisova L. T., Molokeev M. S., Krylov A. S., Aleksandrovsky A. S., Irtyugo L. A., Beletskii V. V., Denisov V. M.
Заглавие : Synthesis, crystal structure, luminescence, and thermophysical properties of TbGaGe2O7
Место публикации : Phys. Solid State. - 2021. - Vol. 63, Is. 1. - P.75-78. - ISSN 10637834 (ISSN), DOI 10.1134/S106378342101008X
Примечания : Cited References: 11. - We are grateful to the Krasnoyarsk Regional Center for Collective Use, Krasnoyarsk Scientific Center, Siberian Branch of the Russian Academy of Sciences
Аннотация: Germanate TbGaGe2O7 has been obtained from the initial Tb2O3, Ga2O3, and GeO2 oxides by the solid-phase synthesis. The germanate structure has been established by X-ray diffraction. Room-temperature luminescence spectra of the compound have been recorded. The effect of temperature on the heat capacity of the oxide compound has been investigated by differential scanning calorimetry. The thermodynamic properties of the compound have been calculated from the experimental Cp = f(T) data.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Abylgazina L., Senkovska I., Ehrling S., Bon V., St. Petkov P., Evans J. D., Krylova S. N., Krylov A. S., Kaskel S.
Заглавие : Tailoring adsorption induced switchability of a pillared layer MOF by crystal size engineering
Место публикации : CrystEngComm. - 2021. - Vol. 23, Is. 3. - P.538-549. - ISSN 14668033 (ISSN), DOI 10.1039/d0ce01497d
Примечания : Cited References: 71. - The authors thank the DFG (FOR 2433 MOF Switches, Project No. 279409724) for financial support. P.P. and J. D. E. thank Center for Information Services and High Performance Computing (ZIH) at TU Dresden for providing high-performance computing facilities. Authors acknowledge Helmholtz-Zentrum Berlin für Materialien und Energie for allocated beamtime at KMC-2 and MX14.2 beamlines. J. D. E. acknowledges the support of the Alexander von Humboldt foundation and HPC platforms provided by a GENCI grant (A0070807069)
Аннотация: The pillared layer framework DUT-8(Zn) (Zn2(2,6-ndc)2(dabco), 2,6-ndc = 2,6-naphthalenedicarboxylate, dabco = 1,4-diazabicyclo-[2.2.2]-octane, DUT = Dresden University of Technology) is a prototypical switchable MOF, showing characteristic adsorption and desorption induced open phase (op) to closed phase (cp) transformation associated with huge changes in cell volume. We demonstrate switchability strongly depends on a framework-specific critical particle size (dcrit). Superposed, the solvent removal process (pore desolvation stress contracting the framework) significantly controls the cp/op ratio after desolvation and, subsequently, the adsorption induced switchability characteristics of the system. After desolvation, the dense cp phase of DUT-8(Zn) shows no adsorption-induced reopening and therefore is non-porous for N2 at 77 K and CO2 at 195 K. However, polar molecules with a higher adsorption enthalpy, such as chloromethane at 249 K and dichloromethane (DCM) at 298 K can reopen the macro-sized crystals upon adsorption. For macro-sized particles, the outer surface energy is negligible and only the type of metal (Zn, Co, Ni) controls the DCM-induced gate opening pressure. The node hinge stiffness increases from Zn to Ni as confirmed by DFT calculations, X-ray crystal structural analysis, and low frequency Raman spectroscopy. This softer Zn-based node hinges and overall increased stabilization of cp vs. op phase shift the critical particle size at which switchability starts to become suppressed to even lower values (dcrit ‹ 200 nm) as compared to the Ni-based system (dcrit ≈ 500 nm). Hence, the three factors affecting switchability (energetics of the empty host, (Eop–Ecp) (I), particle size (II), and desolvation stress (III)) appear to be of the same order of magnitude and should be considered collectively, not individually.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Kostyukov A. I., Snytnikov V. N., Snytnikov V. N., Rakhmanova M. I., Kostyukova N. Y., Ishchenko A. V., Cherepanova S. V., Krylov A. S., Aleksandrovsky A. S.
Заглавие : Synthesis, structure and photoluminescent properties of Eu:Gd2O3 nanophosphor synthesized by cw CO2 laser vaporization
Место публикации : J. Lumines. - 2021. - Vol. 235. - Ст.118050. - ISSN 00222313 (ISSN), DOI 10.1016/j.jlumin.2021.118050
Примечания : Cited References: 42. - The TEM studies are conducted using the equipment of the Center of Collective Use « National Center of Catalyst Research». This work is financially supported by the Russian Foundation for Basic Research (RFBR), Project no. 19-32-60027
Аннотация: Europium doped Gd2O3 sphere-like nanoparticles with dm = 9.3 ± 3.5 nm were synthesized by cw CO2 laser vaporization technique in a flowing mixture of argon and oxygen. According to XRD data, the Eu:Gd2O3 nanoparticles crystallize in the monoclinic symmetry class (C2/m space group). High-resolution luminescence spectroscopy study showed that the ultra-narrow 5D0 → 7F0 transition of Eu3+ demonstrates only two peaks corresponding to two inequivalent Cs positions of Eu3+ ion in monoclinic Gd2O3 lattice that is explained by the peculiarities of local environment of Eu3+ ion at these sites. The hypersensitive transition 5D0 → 7F2 dominates in the spectrum and is expanded to the red part of the spectrum in comparison with cubic Eu:Gd2O3 due to intense transitions terminating at higher-lying components of the crystal-field-split 7F2 state. In the luminescence spectrum, an additional weak band with the maximum at 407 nm corresponding to the electronic transitions 4f65 d1(7FJ) → 4f7(8S7/2) of Eu2+ was detected. The obtained values of chromaticity coordinates and absolute quantum yield are (0.644; 0.325) and ca. 1%, respectively. The phase transformations have been investigated using differential scanning calorimetry and thermogravimetry (50–1400 °C). After annealing in air at 700 °C, the monoclinic symmetry class of the Eu:Gd2O3 nanoparticles is preserved and the particle size increases to dm = 17.8 ± 6.1 nm. After annealing, the chromaticity coordinates (0.659; 0.334) and absolute quantum yield (ca. 4%) can be obtained using red phosphor based on monoclinic Gd2O3:Eu3+. The lifetime of the excited 5D0 state of Eu3+ in the annealed nanoparticles is longer than that in the as-synthesized nanoparticles, due to the suppression of nonradiative decay after annealing.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Денисова Л. Т., Молокеев, Максим Сергеевич, Крылов, Александр Сергеевич, Александровский, Александр Сергеевич, Иртюго Л. А., Белецкий В. В., Денисов В. М.
Заглавие : Синтез, кристаллическая структура, люминесценция и теплофизические свойства TbGaGe2O7
Место публикации : Физ. тверд. тела. - 2021. - Т. 63, Вып. 1. - С. 76-79. - ISSN 0367-3294, DOI 10.21883/FTT.2021.01.50401.190
Примечания : Библиогр.: 11. - Авторы выражают благодарность Красноярскому региональному центру коллективного пользования ФИЦ КНЦ СО РАН
Аннотация: Твердофазным методом из исходных оксидов Tb2O3, Ga2O3 и GeO2 синтезирован германат TbGaGe2O7. С использованием рентгеновской дифракции определена его структура. При комнатной температуре измерены спектры люминесценции. Методом дифференциальной сканирующей калориметрии исследовано влияние температуры на теплоемкость оксидного соединения. По экспериментальным данным Cp=f(T) рассчитаны термодинамические свойства.
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Вид документа : Статья из сборника (однотомник)
Шифр издания :
Автор(ы) : Пугачев А. М., Зайцева И. В., Суровцев, Николай Владимирович, Крылов, Александр Сергеевич
Заглавие : Ангармонизм и локальные нецентросимметричные области в прессованном порошке BaTiO3
Коллективы : Исследование сегнетоэлектрических материалов российскими учеными. Столетие открытия сегнетоэлектричества, международная онлайн-конференция, Уральский Федеральный университет им. Первого Президента России Б.Н. Ельцина
Место публикации : Втюрин, Александр Николаевич Исследование сегнетоэлектрических материалов российскими учеными. Столетие открытия сегнетоэлектричества, международная онлайн-конференция (2020 ; 14-19 сент. ; Екатеринбург). Международная онлайн-конференция "Исследование сегнетоэлектрических материалов российскими учеными. Столетие открытия сегнетоэлектричества" (СЭ-100): сб. тезисов/ Александр Николаевич Втюрин ; чл. прогр. ком. А. Н. Втюрин. - 2020. - Ст.С32. - С. 99. - ISBN 978-5-9500624-3-8
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Вид документа : Статья из сборника (однотомник)
Шифр издания :
Автор(ы) : Крылов, Александр Сергеевич, Мошкина, Евгения Михайловна, Гудим, Ирина Анатольевна, Крылова, Светлана Николаевна, Втюрин, Александр Николаевич
Заглавие : Фазовые переходы в кристаллах мультиферроиков со структурой хантита, содержащих ионы редкоземельных элементов - исследования методом комбинационного рассеяния света
Коллективы : Исследование сегнетоэлектрических материалов российскими учеными. Столетие открытия сегнетоэлектричества, международная онлайн-конференция, Уральский Федеральный университет им. Первого Президента России Б.Н. Ельцина
Место публикации : Втюрин, Александр Николаевич Исследование сегнетоэлектрических материалов российскими учеными. Столетие открытия сегнетоэлектричества, международная онлайн-конференция (2020 ; 14-19 сент. ; Екатеринбург). Международная онлайн-конференция "Исследование сегнетоэлектрических материалов российскими учеными. Столетие открытия сегнетоэлектричества" (СЭ-100): сб. тезисов/ Александр Николаевич Втюрин ; чл. прогр. ком. А. Н. Втюрин. - 2020. - Ст.П17. - С. 26-27. - ISBN 978-5-9500624-3-8
Примечания : Cited References: 7
Аннотация: Изучены эффекты, связанные с параметрами структурного порядка и магнитного упорядочения при фазовых переходах в спектрах комбинационного рассеяния света монокристаллов и твердых растворов кристаллов (Hо-Nd)Fe3(BO3)4, (Sm-La)Fe3(BO3)4, Hо(Fe-Ga)3(BO3)4, Tb(Fe-Ga)3(BO3)4 и Nb(Fe-Ga)3(BO3)4.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Ruseikina A. V., Molokeev M. S., Chernyshev V. А., Aleksandrovsky A. S., Krylov A. S., Krylova S. N., Velikanov D. A., Grigoriev M. V., Maximov N. G., Shestakov N. P., Garmonov A. A., Matigorov A. V., Tarasov A. S., Rautskii M. V., Khritokhin N. А., Melnikova L. V., Tretyakov N. Y.
Заглавие : Synthesis, structure, and properties of EuScCuS3 and SrScCuS3
Место публикации : J. Solid State Chem. - 2021. - Vol. 296. - Ст.121926. - ISSN 00224596 (ISSN), DOI 10.1016/j.jssc.2020.121926
Примечания : Cited References: 72. - The work was supported by the Ministry of Science and Higher Education of the Russian Federation under Project No. FEUZ-2020-0054; by RFBR Grant 18-02-00754 ; by the “UMNIK” program research project № 14977GY/2019; by the Ministry of Science and Higher Education of the Russian Federation (contract no. 05.594.21.0019 , unique identification number RFMEFI59420X0019). Maxim S. Molokeev, Anton S. Tarasov and Mikhail V. Rautskii acknowledge additional funding from Research Grant No. 075-15-2019-1886 from the Government of the Russian Federation. The subset research was performed in Research Resource Center “Natural Resource Management and Physico-Chemical Research.” The use of equipment of Krasnoyarsk Regional Center of Research Equipment of Federal Research Center « Krasnoyarsk Science Center SB RAS» is acknowledged
Аннотация: The crystal structures of the first-synthesized compound EuScCuS3 and previously known SrScCuS3 are refined by Rietveld analysis of X-ray powder diffraction data. The structures are found to belong to orthorhombic crystal system, space group Cmcm, structural type KZrCuS3, with a = 3.83413(3) Å, b = 12.8625(1) Å, c = 9.72654(8) Å (SrScCuS3) and a = 3.83066(8) Å, b = 12.7721(3) Å, c = 9.7297(2) Å (EuScCuS3). The temperatures and enthalpies of incongruent melting are the following: Тm = 1524.5 К, ΔHm = 21.6 kJ•mol−1 (SrScCuS3), and Тm = 1531.6 К, ΔHm = 26.1 kJ•mol−1 (EuScCuS3). Ab initio calculations of the crystal structure and phonon spectrum of the compounds were performed. The types and wavenumbers of fundamental modes were determined and the involvement of ions participating in the IR and Raman modes was assessed. The experimental IR and Raman spectra were interpreted. EuScCuS3 manifests a ferromagnetic transition at 6.4 K. The SrScCuS3 compound is diamagnetic. The optical band gaps were found to be 1.63 eV (EuScCuS3) and 2.24 eV (SrScCuS3) from the diffuse reflectance spectra. The latter value is in good agreement with that calculated by the DFT method. The narrower band gap of EuScCuS3 is explained by the presence of 4f-5d transition in Eu2+ ion that indicates a possibility to control the band gap of the chalcogenides by the inclusion of Eu. The activation energy of crystal structure defects, being the source of additional absorption in the NIR spectral range, was found to be 0.29 eV.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Denisenko Y. G., Sedykh A. E., Molokeev M. S., Oreshonkov A. S., Aleksandrovsky A. S., Krylov A. S., Khritokhin N. A., Sal'nikova E. I., Andreev O. V., Muller-Buschbaum K.
Заглавие : Crystal and electronic structure, thermochemical and photophysical properties of europium-silver sulfate monohydrate AgEu(SO4)2·H2O
Место публикации : J. Solid State Chem. - 2021. - Vol. 294. - Ст.121898. - ISSN 00224596 (ISSN), DOI 10.1016/j.jssc.2020.121898
Примечания : Cited References: 54. - This work was partially supported by the Russian Foundation for Basic Research (Grant 19-33-90258∖19 ). Use of equipment of Krasnoyarsk Regional Center of Research Equipment of Federal Research Center « Krasnoyarsk Science Center SB RAS» is acknowledged
Аннотация: In order to synthesize single crystals of europium-silver double sulfate monohydrate, a hydrothermal reaction route was used. It was found that the crystallization cannot be performed under standard conditions. The compound AgEu(SO4)2·H2O crystallizes in the trigonal crystal system, space group P3221 (a = 6.917(1), c = 12.996(2) Å, V = 538.53(17) Å3). The structure consists of triple-capped trigonal prisms [EuO9], in which one oxygen atom belongs to crystalline water, silver octahedra [AgO6], and sulfate tetrahedra [SO4]. The hydrogen bonds in the system additionally stabilize the structure. The electronic band structure wasstudied by density functional theory calculations which show that AgEu(SO4)2·H2O is an indirect band gap dielectric. Temperature dependent photoluminescence spectroscopy shows emission bands of transitions from the 5D0 state to the spin-orbit components of the 7FJmultiplet (J = 0–6).The ultranarrow transition 5D0 - 7F0 shows a red shift with respect to other europium-containing water-free sulfates that is ascribed to the presence of OH group in the crystal structure in the close vicinity of the Eu3+ ion. An effect of abnormal sensitivity of the Ω4 intensity factor to minor distortions of the local environment is detected for the observed low local symmetry of C2.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Yushina, Irina, Krylov A. S., Leonidov, Ivan I., Batalov, Vladimir, Chen, Yu-Sheng, Wang, Suyin Grass, Stash, Adam, Bartashevich E. V.
Заглавие : The influence of chalcogen atom on conformation and phase transition in chalcogenazinoquinolinium monoiodides
Коллективы : Ministry of Science and High Education of Russian Federation [FENU 2020-0019]; ISSC UB RAS [AAAA-A19-119031890025-9]; Divisions of Chemistry (CHE) and Materials Research (DMR), National Science Foundation [NSF/CHE-1346572]; US DOEUnited States Department of Energy (DOE) [DE-AC02-06CH11357]
Место публикации : Acta Crystallogr. B. - 2021. - Vol. 77. - P.526-536. - ISSN 2052-5206, DOI 10.1107/S2052520621004571
Примечания : Cited References: 61. - This work was supported by the Ministry of Science and High Education of Russian Federation, project FENU 2020-0019. Additional spectroscopic studies were carried out in ISSC UB RAS (Research Program No. AAAA-A19-119031890025-9). Technical assistance from Ivan D. Popov (ISSC UB RAS) is strongly acknowledged. ChemMatCARS Sector 15 is principally supported by the Divisions of Chemistry (CHE) and Materials Research (DMR), National Science Foundation, under grant number NSF/CHE-1346572. Use of the Advanced Photon Source, an Office of Science User Facility operated for the US Department of Energy (DOE) Office of Science by Argonne National Laboratory, was supported by the US DOE under Contract No. DE-AC02-06CH11357
Предметные рубрики: LARGE STOKES SHIFT
D-PI-A
HALOGEN BONDS
ELECTRON LOCALIZATION
Аннотация: Crystalline chalcogenazinoquinolinium monoiodides, where the chalcogen atom is oxygen and sulfur, were studied using a combination of X-ray diffraction, Raman and UV-vis spectroscopies and photoluminescence experimental techniques. Periodic quantum-chemical calculations were performed to characterize the features of electronic structure and vibrational assignment. X-ray diffraction and Raman spectroscopy experiments consistently reveal phase transition of thiazinoquinolinium monoiodide at low temperatures with the decrease of symmetry to P1. The luminescence study for oxazinoquinolinium monoiodide reveals the excitation maximum at 532 nm and emission at 650 nm with significantly higher intensity than for the thiazinoquinolinium derivative. The studied chalcogenazinoquinolinium monoiodides demonstrate high values of Stokes shift up to 150 nm.
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10.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Moshkina E. M., Bovina A. F., Molokeev M. S., Krylov A. S., Shabanov A. V., Chernyshov A. V., Sofronova S. N.
Заглавие : Study of flux crystal growth peculiarities, structure and Raman spectra of double (Mn,Ni)3BO5 and triple (Mn,Ni,Cu)3BO5 oxyborates with ludwigite structure
Коллективы : Russian Foundation for Basic ResearchRussian Foundation for Basic Research (RFBR); Government of the Krasnoyarsk Krai; Krasnoyarsk Territorial Foundation for Support of Scientific and RD Activities [20-42-240011]
Место публикации : CrystEngComm. - 2021. - Vol. 23, Is. 33. - P.5624-5635. - ISSN 1466-8033(eISSN), DOI 10.1039/d1ce00750e
Примечания : Cited References: 32. - This work was supported by the Russian Foundation for Basic Research, the Government of the Krasnoyarsk Krai, and the Krasnoyarsk Territorial Foundation for Support of Scientific and R&D Activities, project no. 20-42-240011. X-ray and EDX data were obtained with the use of the analytical equipment of the Krasnoyarsk Regional Center of Research Equipment of Federal Research Center "Krasnoyarsk Science Center SB RAS"
Предметные рубрики: MAGNETIC-PROPERTIES
SINGLE-CRYSTAL
Аннотация: Crystallization of heterovalent double (Mn,Ni)3BO5 and triple (Mn,Ni,Cu)3BO5 oxyborates with the ludwigite structure is studied in fluxes based on Bi2Mo3O12 diluted with Na2CO3 or Li2CO3 carbonates. Single crystals of five (Mn,Ni)3BO5 and three (Mn,Ni,Cu)3BO5 compounds with different cation ratios are obtained. The ion concentration is determined from the analysis of the lattice parameters by powder and single crystal XRD. The comparative analysis of the polarized Raman spectra of double and triple ludwigites is presented. The actual high nickel and small copper concentrations in the crystals are discussed. The hierarchy of chemical bonds in the fluxes used in addition to the approach involving stabilization of the manganese valence state using solvent components is estimated.
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