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Каталог книг и брошюр библиотеки ИФ СО РАН

Каталог журналов библиотеки ИФ СО РАН

Труды сотрудников ИФ СО РАН

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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Avramov P. V., Sakai S., Entani S., Matsumoto Y., Naramoto, Hiroshi
Заглавие : Ab initio LC-DFT study of graphene, multilayer graphenes and graphite
Место публикации : Chem. Phys. Lett.: Elsevier Science BV, 2011. - Vol. 508, Is. 1-3. - P.86-89. - ISSN 0009-2614, DOI 10.1016/j.cplett.2011.04.016
Примечания : Cited References: 32. - This work was supported by JAEA Research fellowship (P.V.A.). P.V.A. also acknowledges JAEA ASRC and Molecular Spintronics Group for hospitality and fruitful collaboration.
Предметные рубрики: DENSITY
NANORIBBONS
PERFORMANCE
FUNCTIONALS
FULLERENE
COBALT
FILMS
Аннотация: Atomic structure of graphene, bi-, tri-, tetralayer graphenes and graphite as well was studied using ab initio HSE, LDA and PBE DFT approaches in periodic boundary conditions. Based on comparison of theoretical results with experimental data the performance of the methods was estimated. It was found that long-range corrected HSE potential is the most reliable DFT approximation to reproduce the atomic structure of weakly bound multilayer graphenes and graphite as well. (C) 2011 Elsevier B. V. All rights reserved.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Vereshchagin S. N., Solovyov L. A., Rabchevskii E. V., Dudnikov V. A., Ovchinnikov S. G., Anshits A. G.
Заглавие : Methane oxidation over A-site ordered and disordered Sr0.8Gd0.2CoO3−δ perovskites
Коллективы : SB RAS project [38]; RFBR [13-02-00358]
Место публикации : Chem. Commun.: Royal Society of Chemistry, 2014. - Vol. 50, Is. 46. - P.6112-6115. - ISSN 1359-7345, DOI 10.1039/c4cc00913d. - ISSN 1364-548X
Примечания : Cited References: 20. - The authors acknowledge the financial support from SB RAS project N 38 (2012) and RFBR grant 13-02-00358.
Предметные рубрики: MEMBRANE REACTORS
OXYGEN
OXIDES
PERFORMANCE
COMBUSTION
FEATURES
PHASES
Аннотация: A tetragonal phase Sr0.8Gd0.2CoO3−δ with ordered Gd3+/Sr2+ ions and oxygen vacancy sites is found to be about five times less active in the reaction of methane combustion than a quenched cubic perovskite phase with randomly distributed (disordered) Gd3+/Sr2+ ions over the A-sites of the crystal lattice.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Vereshchagin S. N., Solov'ev L. A., Rabchevskii E. V., Dudnikov V. A., Ovchinnikov S. G., Anshits A. G.
Заглавие : New method for regulating the activity of ABO3 perovskite catalysts
Коллективы : Council of the President of the Russian Federation for Support of Young Scientists and Leading Scientific Schools [NSh-2886.2014.2]
Место публикации : Kinet. Catal.: MAIK Nauka-Interperiodica / Springer, 2015. - Vol. 56, Is. 5. - P.640-645. - ISSN 0023, DOI 10.1134/S0023158415040199. - ISSN 16083210(eISSN)
Примечания : Cited References:23. - This work was supported in part by the Council of the President of the Russian Federation for Support of Young Scientists and Leading Scientific Schools (grant no. NSh-2886.2014.2).
Предметные рубрики: MEMBRANE REACTORS
METHANE COMBUSTION
OXIDATION
OXIDES
OXYGEN
PERFORMANCE
FEATURES
PHASES
CO
Ключевые слова (''Своб.индексиров.''): perovskite--cobalt--methane--deep oxidation--oxidative condensation
Аннотация: A new possibility of changing the activity and selectivity of perovskite catalysts in the oxidative conversion of methane was demonstrated using the Sr x Gd1–x CoO3–δ (0.5 x 0.9) compounds as an example. It was established that, at the same chemical composition, the disordering of Sr2+/Gd3+ ions over the A positions of the crystal structure led to a significant increase in activity in the deep oxidation reaction of CH4, as compared with the samples with an ordered distribution of cations.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Anshits A. G., Bayukov O. A., Kondratenko E. V., Anshits N. N., Pletnev O. N., Rabchevskii E. V., Solovyov L. A.
Заглавие : Catalytic properties and nature of active centers of ferrospheres in oxidative coupling of methane
Коллективы : Russian Science Foundation [14-13-00289]
Место публикации : Appl. Catal. A-Gen.: Elsevier Science, 2016. - Vol. 524. - P.192-199. - ISSN 0926-860X, DOI 10.1016/j.apcata.2016.06.032. - ISSN 1873-3875(eISSN)
Примечания : Cited References:47. - This study was supported by the Russian Science Foundation (project no. 14-13-00289).
Предметные рубрики: GLASS CRYSTAL CATALYSTS
MAGNETIC-PROPERTIES
PROFILE REFINEMENT
FLY-ASH
MOSSBAUER
MICROSPHERES
PERFORMANCE
CONVERSION
ETHYLENE
OXIDE
Ключевые слова (''Своб.индексиров.''): methane coupling--active center--ferrospinel--mossbauer spectroscopy
Аннотация: Ferrospheres with the Fe2O3 content in the range from 76 to 97 wt% were applied as catalysts for the oxidative coupling of methane (OCM). To identify their phase composition and distribution of iron sites, the ferrospheres were characterized by X-ray powder diffraction and Mossbauer spectroscopy before and after the OCM reaction. Magnetite-based ferrite spinel, hematite and aluminosilicate glasses were established to be the main phases. The ferrospinel of all ferrospheres partially oxidized to hematite after the OCM reaction. It was established that the yield of C-2-hydrocarbons sharply increased at the ferrospheres with Fe2O3 content higher than 89 wt% The spinel phase of these ferrospheres includes Fevv3+(B) sites with a Ca2+ tetrahedral cation and an octahedral cation vacancy among the nearest neighbors. A linear correlation between the yield of C-2-hydrocarbons (ethane and ethylene) and the content of such sites was established, thus indicating that their electrophilic oxygen species participate in selective CH4 conversion to C2H6. (C) 2016 Elsevier B.V. All rights reserved.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Vereshchagin S. N., Dudnikov V. A., Shishkina N. N., Solovyov L. A.
Заглавие : Phase transformation behavior of Sr0.8Gd0.2CoO3-delta perovskite in the vicinity of order-disorder transition
Коллективы : Russian Foundation for Basic Research, Government of Krasnoyarsk Territory, Krasnoyarsk Region Science and Technology Support Fund [16-43-240505 p_a, 16-02-00507A]
Место публикации : Thermochim. Acta: Elsevier Science, 2017. - Vol. 655. - P.34-41. - ISSN 0040-6031, DOI 10.10164/j.tca.2017.06.003. - ISSN 1872-762X(eISSN)
Примечания : Cited References:40. - The reported study was funded by Russian Foundation for Basic Research, Government of Krasnoyarsk Territory, Krasnoyarsk Region Science and Technology Support Fund to the research project #16-43-240505 p_a and #16-02-00507A.
Предметные рубрики: OXYGEN SORPTION
OXIDES
PERFORMANCE
DIFFUSE
LN
Ключевые слова (''Своб.индексиров.''): perovskite--ruddlesden-popper phase--order-disorder--phase transition--dsc
Аннотация: The phase transformation behavior of a single-phase tetragonal Sr0.8Gd0.2CoO3-δ (with ordered distribution of Sr2+/Gd3+ cations and anion vacancies) was investigated by TG–DSC and XRD at 1100–1473 K and oxygen partial pressure p(O2) from 1 to 5·104 Pa. The first-order smeared order-disorder (o-d) phase transition involving heat absorption was observed at about 1383 K under O2-Ar flow with p(O2) 2.5 kPa. The crystal structure of the high-temperature phase was found to be cubic perovskite with disordered Sr2+/Gd3+ cations and anion vacancies. The temperature of o-d transition at p(O2) 2.5 kPa was not influenced by the heating rate or oxygen partial pressure. It was shown that at p(O2) 2.5 kPa the o-d transition gives rise to Sr0.8Gd0.2CoO3−δ decomposition to form CoO and Sr2.4Gd0.6Co2O7-δ − Ruddlesden-Popper type phase with novel composition. The phase boundaries between the ordered tetragonal Sr0.8Gd0.2CoO3−δ, disordered cubic Sr0.8Gd0.2CoO3−δ and CoO + Sr2.4Gd0.6Co2O7-δ composite as a function of temperature and p(O2) values were determined.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Верещагин С. Н., Дудников, Вячеслав Анатольевич, Соловьев, Леонид Александрович
Заглавие : Изучение фазового перехода порядок-беспорядок в нестехиометрическом Sr-Gd-кобальтате методами ДСК, ТГ и РСА
Место публикации : Журн. СФУ. Сер. "Химия". - 2016. - Т. 9, № 3. - С. 326-336. - ISSN 1998-2836, DOI 10.17516/1998-2836-2016-9-3-326-336; J. Sib. Fed. Univ. Chem. - ISSN 2313-6049(eISSN)
Примечания : Библиогр.: 26. - Исследование выполнено при финансовой поддержке Российского фонда фундаментальных исследований, Правительства Красноярского края, Красноярского краевого фонда поддержки научной и научно-технической деятельности в рамках научного проекта 16-43-240505 «р_а».
Предметные рубрики: PEROVSKITE-TYPE OXIDES
PHASE-TRANSITION
OXYGEN SORPTION
PERFORMANCE
Ключевые слова (''Своб.индексиров.''): perovskite--order-disorder--phase transition--dsc--перовскит--порядок-беспорядок--фазовый переход--дск
Аннотация: Методами термического и рентгеноструктурного анализа в интервале температур 11001473 К изучен процесс взаимопревращения тетрагонального перовскита Sr ( 0.8 ) Gd ( 0.2 ) CoO ( 3-d ) с упорядоченным расположением катионов Sr/Gd и анионных вакансий в кубическую разупорядоченную модификацию. Показано, что фазовое превращение протекает как размытый фазовый переход первого рода. Процесс разупорядочения не зависит от скорости нагрева и контролируется термодинамическими характеристиками процессов в кристалле, тогда как процесс образования упорядоченной тетрагональной структуры контролируется кинетическими факторами. Проведен количественный анализ температурной зависимости теплоемкости на основе размытых фазовых переходов.Process of interconversion of tetragonal Sr(0.8) Gd(0.2) CoO(3-d) (with ordered Sr/Gd cations and anion vacancies) to cubic one (with disordered structure) was studied by X-ray structural and thermal analysis at 1100-1473 K. It was shown that the transformation is a first order diffuse phase transition. The ramp rate does not affect cation and anion vacancies disordering which is controlled by thermodynamic parameters of the processes in the solid whereas cubic to tetragonal transition is kinetically controlled. A theory of diffuse phase transition was applied to quantitatively analyze heat capacity temperature dependence.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Yang, Xiang, Zhang, Y.u., Zhang, Xuejie, Chen, Jian, Huang, Haisen, Wang, Dongsheng, Chai, Xirong, Xie, Gening, Molokeev M. S., Zhang, Haoran, Liu, Yingliang, Lei, Bingfu
Заглавие : Facile synthesis of the desired red phosphor Li2Ca2Mg2Si2N6:Eu2+ for high CRI white LEDs and plant growth LED device
Место публикации : J. Am. Ceram. Soc. - 2020. - Vol. 103, Is. 3. - P.1773-1781. - ISSN 0002-7820, DOI 10.1111/jace.16858. - ISSN 1551-2916(eISSN)
Примечания : Cited References: 34. - National Natural Science Foundations of China, Grant/Award Number: 21671070 and 51802101; Project GDUPS; Natural Science Foundation of Guangdong Province, Grant/Award Number: 2018A030310217; Guangzhou Science & Technology Project, Grant/Award Number: 201704030086; Guangdong Provincial Special Fund for Modern Agriculture Industry Technology Innovation Teams; National Undergraduate Innovation and Entrepreneurship Training Program granted for Gening Xie, Grant/Award Number: 201910564035
Предметные рубрики: IN-GLASS
LUMINESCENCE
PERFORMANCE
EFFICIENT
EMISSION
ROUTE
Аннотация: The red emission with suitable peak wavelength and narrow band is acutely required for high color rendering index (CRI) white LEDs without at the cost of the luminous efficacy. Herein, the Li2Ca2Mg2Si2N6:Eu2+ red phosphor was prepared with facile solid‐state method using Ca3N2, Mg3N2, Si3N4, Li3N, and Eu2O3 as the safety raw materials under atmospheric pressure for the first time, which shows red emission peaking at 638 nm with full width at half maximum (FWHM) of 62 nm under blue light irradiation and becomes the desired red phosphor to realize the balance between luminous efficacy and high CRI in white LEDs. The morphology, structure, luminescence properties, thermal quenching behavior, and chromaticity stability of the Li2Ca2Mg2Si2N6:Eu2+ phosphor are investigated in detail. Concentration quenching occurs when the Eu2+ content exceeds 1.0 mol%, whereas high‐temperature photoluminescent measurements show a 32% drop from the room‐temperature efficiency at 423 K. In view of the excellent luminescence performances of Li2Ca2Mg2Si2N6:Eu2+ phosphor, a white LEDs with CRI of 91 as a proof‐of‐concept experiment was fabricated by coating the title phosphor with Y3Al5O12:Ce3+ on a blue LED chip. In addition, the potential application of the title phosphor in plant growth LED device was also demonstrated. All the results indicate that Li2Ca2Mg2Si2N6:Eu2+ is a promising red‐emitting phosphor for blue LED‐based high CRI white LEDs and plant growth lighting sources.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Orlov Yu. S., Vereshchagin S. N., Novikov, S., V, Burkov A. T., Borus A. A., Sitnikov, M., V, Solovyov L. A., Volochaev M. N., Dudnikov V. A.
Заглавие : Effect of mechanical activation on the thermoelectric properties of Sr1-xSmxTiO3 ceramics
Коллективы : Russian Science FoundationRussian Science Foundation (RSF) [19-72-00097]
Место публикации : Ceram. Int. - 2021. - Vol. 47, Is. 20. - P.28992-28999. - ISSN 0272-8842, DOI 10.1016/j.ceramint.2021.07.060. - ISSN 1873-3956(eISSN)
Примечания : Cited References: 31. - This study was supported by the Russian Science Foundation, project no. 19-72-00097
Предметные рубрики: SRTIO3
LA
MICROSTRUCTURE
CONDUCTIVITY
PERFORMANCE
FIGURE
MERIT
Аннотация: The Sr1-xSmxTiO3 (х = 0.025, 0.05, 0.075, 0.1, 0.2) strontium titanate solid solutions were prepared from oxides and carbonates using a conventional ceramic technology based on the mechanochemical activation. The electrical conductivity and Seebeck coefficient of the synthesized compounds were measured in the temperature range from 300 to 800 K. We found that the properties of the samples significantly depend on the preliminary mechanochemical activation. The thermoelectric power factor attains maximum value in the hydrogen reduced samples with concentration of х = 0.05 and 0.075 obtained from nanoparticles: 5.5 μW/(cm · K2) for Sr0.95Sm0.05TiO3 (580 K) and 4.10 μW/(cm · K2) for Sr0.925Sm0.075TiO3 (650 K). An increase in the annealing temperature of mechanically activated samples leads to an even greater increase in electrical conductivity and power factor: 9.2 μW/(cm · K2) for Sr0.925Sm0.075TiO3 (650 K).
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Voronin, Anton S., Fadeev, Yurii V., Makeev, Mstislav O., Mikhalev, Pavel A., Osipkov, Alexey S., Provatorov, Alexander S., Ryzhenko, Dmitriy S., Yurkov, Gleb Y., Simunin, Mikhail M., Karpova, Darina V., Lukyanenko A. V., Kokh, Dieter, Bainov, Dashi D., Tambasov I. A., Nedelin, Sergey V., Zolotovsky, Nikita A., Khartov, Stanislav V.
Заглавие : Low cost embedded copper mesh Based on cracked template for highly durability transparent EMI shielding films
Коллективы : Ministry of Science and Higher Education of the Russian Federation [0705-2020-0032]; [0287-2021-0026]
Место публикации : Materials. - 2022. - Vol. 15, Is. 4. - Ст.1449. - ISSN 1996-1944(eISSN), DOI 10.3390/ma15041449
Примечания : Cited References: 55. - This research work was supported by the Ministry of Science and Higher Education of the Russian Federation within the framework of state tasks No. 0287-2021-0026 and No. 0705-2020-0032
Предметные рубрики: PERFORMANCE
REALIZATION
ELECTRODE
NANOMESH
PATTERN
Аннотация: Embedded copper mesh coatings with low sheet resistance and high transparency were formed using a low-cost Cu seed mesh obtained with a magnetron sputtering on a cracked template, and subsequent operations electroplating and embedding in a photocurable resin layer. The influence of the mesh size on the optoelectric characteristics and the electromagnetic shielding efficiency in a wide frequency range is considered. In optimizing the coating properties, a shielding efficiency of 49.38 dB at a frequency of 1 GHz, with integral optical transparency in the visible range of 84.3%, was obtained. Embedded Cu meshes have been shown to be highly bending stable and have excellent adhesion strength. The combination of properties and economic costs for the formation of coatings indicates their high prospects for practical use in shielding transparent objects, such as windows and computer monitors.
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