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Общее количество найденных документов : 138
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1.

Вид документа : Однотомное издание
Шифр издания : В37/Б 82 рукописный текст
Автор(ы) : Борисов, Алексей Александрович
Заглавие : Температурная и концентрационная зависимости электронной структуры оксидов меди в рамках обобщенного метода сильной связи : дис. на соиск. уч. степени канд. физ.-мат. наук : 01.04.07 : защищена 25.12.2002
Выходные данные : Красноярск, 2002
Колич.характеристики :173 с
Коллективы : Российская академия наук, Сибирское отделение РАН, Институт физики им. Л.В. Киренского Сибирского отделения РАН
Примечания : Библиогр.: 114 назв.
ГРНТИ : 29.19.24
ББК : В373.1я031
Экземпляры :Дс(1)
Свободны : Дс(1)
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2.

Вид документа : Однотомное издание
Шифр издания : В37/Г 12 рукописный текст
Автор(ы) : Гавричков, Владимир Александрович
Заглавие : Энергетическая структура и свойства сильно коррелированных электронных систем купратов и манганитов : дис. на соиск. уч. степени д-ра физ.-мат. наук : 01.04.07
Выходные данные : Красноярск, 2011
Колич.характеристики :320 с
Коллективы : Российская академия наук, Сибирское отделение РАН, Институт физики им. Л.В. Киренского Сибирского отделения РАН
Примечания : Библиогр.: с. 273-320
ГРНТИ : 29.19.37
ББК : В373.3я031
Экземпляры :ДС(1)
Свободны : ДС(1)
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3.

Вид документа : Однотомное издание
Шифр издания : В37/В 16 рукописный текст
Автор(ы) : Гавричков, Владимир Александрович
Заглавие : Многоэлектронная теория оптических и электрических свойств ферромагнитных хромовых шпинелей : дис. на соиск. уч. степени канд. физ.-мат. наук : 01.04.11 : защищена 10.03.1989
Выходные данные : Красноярск, 1988
Колич.характеристики :113 с
Коллективы : Академия наук СССР, Сибирское отделение АН СССР, Институт физики им. Л.В. Киренского Сибирского отделения АН СССР
Примечания : Библиогр.: 88 назв.
ГРНТИ : 29.19.31 + 29.19.37
ББК : В379.233я031
Экземпляры :ДС(1)
Свободны : ДС(1)
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4.

Вид документа : Статья из сборника (однотомник)
Шифр издания :
Автор(ы) : Ovchinnikov S. G., Makarov I. A., Shneyder E. I., Togushova Yu. N., Korshunov M. M., Gavrichkov V. A.
Заглавие : Magnetic mechanisms of pairing in strongly correlated electron system of copper oxides
Место публикации : Recent advances in superconductivity research. - New York: Nova Science Publishers, 2013. - Chapter 6. - P.93-143. - ISBN 978-1-62618-406-0
Ключевые слова (''Своб.индексиров.''): strong electronic correlations--magnetic mechanism of pairing--quantum phase transitions--electronic structure--hubbard operators--cuprates
Аннотация: The multielectron LDA+GTB approach has been developed to calculate electronic structure of strongly correlated cuprates. At low energies the effective Hamiltonian of the t- t’- t”- t﬩-J*-J﬩ -model has been derived with parameters coming from the ab initio calculation for LSCO. The electronic structure of LSCO has been calculated self-consistently with the short-range antiferromagnetic order for various doping level. Two Lifshitz-type quantum phase transitions with Fermi surface topology changes have been found at dopings x(c1) = 0.15 and x(c2) = 0.24. Its effect on normal and superconducting properties has been calculated. The interatomic ex­ change parameter and its pressure dependence has been calculated within LDA+GTB scheme. The magnetic mechanisms of d-wave pairing induced by static and dynamical spin correlations are discussed. Simultaneous treatment of magnetic and phonon pairing results in the conclusion that both contributions are of the same order. For two layer cuprates like YBCO the interlayer hopping and exchange effects on the electronic structure and doping dependence of Tc is discussed as well as the Coulomb interaction induced mechanism of pairing.
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5.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Ovchinnikov S. G., Gavrichkov V. A., Korshunov M. M., Shneyder E. I.
Заглавие : LDA+GTB method for band structure Calculations in the strongly correlated materials
Место публикации : Strongly correlated system: Theoretical methods/ ed.: A. Avella, F. Mancini: Springer, 2012. - P.143-171. - (Springer series in solid-state sciences; Vol. 171). - ISSN 0171-1873, DOI 10.1007/978-3-642-21831-6_5. - ISSN 978-3-642-21830-9. - ISSN 978-3-642-21831-6
Примечания : Cited References: 70
Аннотация: We present the multielectron LDA+GTB (local density approximation plus generalized tight-binding) approach to the electronic structure calculations for the Mott insulators. This method is a straightforward generalization of the Hubbard perturbation theory which starts from the atomic limit. All local interactions within the unit cell are treated by the exact diagonalization of the multiband p−d Hamiltonian with the parameters calculated within LDA. Intercell Hoppings and interactions between the unit cells are considered as perturbation within the Hubbard X-operators representation. We also discuss the application of the LDA+GTB method to cuprates, manganites, and cobaltites.
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6.

Вид документа : Статья из журнала
Шифр издания : Physics, Applied/C94
Автор(ы) : Korshunov M. M., Ovchinnikov S. G., Shneyder E. I., Gavrichkov V. A., Orlov Yu.S., Nekrasov I. A., Pchelkina Z. V.
Заглавие : Cuprates, manganites and cobaltites: Multielectron approach to the band structure
Место публикации : Mod. Phys. Lett. B: WORLD SCIENTIFIC PUBL CO PTE LTD, 2012. - Vol. 26, Is. 24. - Ст.1230016. - ISSN 0217-9849, DOI 10.1142/S0217984912300165
Примечания : Cited References: 93. - We are thankful to O. K. Andersen, V. I. Anisimov, A. F. Barabanov, K. I. Kikoin, N. M. Plakida, S. Sakai, A.-M.S. Tremblay, V. V. Val'kov, and R. O. Zaitsev for useful discussions. This work was supported by the Presisium of RAS program Quantum physics of condensed matter N 20.7, Grant "Leading scientific schools of Russia" (NSh 1044-2012.2), RFBR (Grant No. 09-02-00127), Integration Grant of SBRAS-UrBRAS N 44, Grant of President of Russia MK-1683.2010.2, FCP Scientific and Research-and-Educational Personnel of Innovative Russia for 2009-2013 (GK 16.740.12.0731 and GK 16.740.11.0740), and Siberian Federal University (Theme N F-11). M.M.K. and E.I.S. acknowledges support from The Dynasty Foundation and ICFPM.
Предметные рубрики: HIGH-TEMPERATURE SUPERCONDUCTORS
MEAN-FIELD THEORY
DENSITY-FUNCTIONAL FORMALISM
CORRELATED ELECTRON-SYSTEMS
TRANSITION-METAL COMPOUNDS
SPIN-STATE TRANSITION
T-J MODEL
MAGNETIC-PROPERTIES
COPPER OXIDES
LaCoO3
Ключевые слова (''Своб.индексиров.''): lda plus gtb method--strongly-correlated systems--band structure
Аннотация: High-T-c superconductors with CuO2 layers, manganites La1-xSrxMnO3 and cobaltites LaCoO3 present several mysteries in their physical properties. Most of them are believed to come from the strongly-correlated nature of these materials. From the theoretical viewpoint, there are many hidden rocks in making the consistent description of the band structure and low-energy physics starting from the Fermi-liquid approach. Here, we discuss the alternative method - multielectron approach to the electronic structure calculations for the Mott insulators - called LDA + GTB (local density approximation + generalized tight-binding) method. Its origin is a straightforward generalization of the Hubbard perturbation theory in the atomic limit and the multiband p - d Hamiltonian with the parameters calculated within LDA. We briefly discuss the method and focus on its applications to cuprates, manganites and cobaltites.
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7.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Gavrichkov V. A.
Заглавие : A simple metal-insulator criterion for the doped Mott-Hubbard materials
Коллективы : RFBR [13-02-01395, 14-02-00186, Nsh-28862014.2]
Место публикации : Solid State Commun.: PERGAMON-ELSEVIER SCIENCE LTD, 2015. - Vol. 208. - P.11-14. - ISSN 0038, DOI 10.1016/j.ssc.2015.02.014. - ISSN 18792766(eISSN)
Примечания : Cited References:19. - We acknowledge with pleasure discussions with Igor S. Sandalov during the course of this work. This work was supported by RFBR Grant nos. 13-02-01395, 14-02-00186, and Nsh-28862014.2.
Предметные рубрики: COOPER PAIRS
Bi2Sr2CaCu2O8+DELTA
Ключевые слова (''Своб.индексиров.''): doped mott-hubbard materials--metal-insulator transition--first removal--electron states
Аннотация: A simple metal-insulator criterion for doped Mott-Hubbard materials has been derived, Its readings are closely related to the orbital and spin nature of the ground states of the unit cell. The available criterion readings (metal or insulator) in the paramagnetic phase reveal the possibility of the insulator state of doped materials with the forbidden first removal electron states. According to its physical meaning, the result is similar to the Wilson's criterion in itinerant electron systems. The application of the criterion to high-T-c cuprates is discussed. (C) 2015 Elsevier Ltd. All rights reserved.
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8.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Shneyder E. I., Spitaler J., Kokorina E. E., Nekrasov I. A., Gavrichkov V. A., Draxl C., Ovchinnikov S. G.
Заглавие : Coupling of Hubbard fermions with phonons in La2 CuO4: A combined study using density-functional theory and the generalized tight-binding method
Место публикации : J. Alloys Compd.: Elsevier, 2015. - Vol. 648. - P.258-264. - ISSN 0925-8388, DOI 10.1016/j.jallcom.2015.05.150
Примечания : Cited References: 60. - We acknowledge the stimulating discussions with V.V. Val'kov, D.M. Dzebisashvilly, M.M. Korshunov and I.S. Sandalov. E.I.S. and S.G.O. are thankful to the Russian Science Foundation (project No. 14-12-00061) for the support of the research given in Sections 2, 6 and 7. E.E.K. and I.A.N. are thankful to the State Contract No. 0389-2014-0001 and RFBR grant No. 14-02-00065 for the support of the research given in Section 5. Financial support of the research given in Sections 3 and 4 by the Austrian Federal Government (in particular from Bundesministerium fur Verkehr, Innovation und Technologie and Bundesministerium fur Wissenschaft, Forschung und Wirtschaft) represented by Osterreichische Forschungsforderungsgesellschaft mbH and the Styrian and the Tyrolean Provincial Government, represented by Steirische Wirtschaftsforderungsgesellschaft mbH and Standortagentur Tirol, within the framework of the COMET Funding Programme is gratefully acknowledged by C.D. and J.S.
Предметные рубрики: MEAN-FIELD THEORY
LINEAR-RESPONSE THEORY
CUPRATE SUPERCONDUCTORS
ELECTRONIC-STRUCTURE
CORRELATED SYSTEMS
LATTICE-DYNAMICS
BAND-STRUCTURE
LA2CUO4
MODEL
LA2-XSRXCUO4
Ключевые слова (''Своб.индексиров.''): high-temperature superconductivity--electron-phonon coupling--density-functional theory--generalized tight-binding approach
Аннотация: We present results for the electron-phonon interaction of the Γ-point phonons in the tetragonal high-temperature phase of La2 CuO4 obtained from a hybrid scheme, combining density-functional theory (DFT) with the generalized tight-binding approach. As a starting point, eigenfrequencies and eigenvectors for the Γ-point phonons are determined from DFT within the frozen phonon approach utilizing the augmented plane wave + local orbitals method. The so obtained characteristics of electron-phonon coupling are converted into parameters of the generalized tight-binding method. This approach is a version of cluster perturbation theory and takes the strong on-site electron correlations into account. The obtained parameters describe the interaction of phonons with Hubbard fermions which form quasiparticle bands in strongly correlated electron systems. As a result, it is found that the Γ-point phonons with the strongest electron-phonon interaction are the A2u modes (236 cm-1, 131 cm-1 and 476 cm-1). Finally it is shown, that the single-electron spectral-weight redistribution between different Hubbard fermion quasiparticles results in a suppression of electron-phonon interaction which is strongest for the triplet Hubbard band with z oriented copper and oxygen electrons. © 2015 Elsevier B.V. All rights reserved.
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9.

Вид документа : Однотомное издание
Шифр издания :
Автор(ы) : Федоров, Александр Семенович, Сорокин, Борис Павлович, Аврамов, Павел Вениаминович, Овчинников, Сергей Геннадьевич
Заглавие : Моделирование свойств, электронной структуры ряда углеродных и неуглеродных нанокластеров и их взаимодействия с легкими элементами [Электронный ресурс]
Выходные данные : Новосибирск: Изд-во СО РАН, 2006
Коллективы : Российская академия наук, Сибирское отделение РАН, Институт физики им. Л.В. Киренского Сибирского отделения РАН, Институт железнодорожного транспорта
ISBN, Цена 5-7692-0817-1:
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10.

Вид документа : Однотомное издание
Шифр издания :
Автор(ы) : Ovchinnikov S. G., Makarov I. A., Shneyder E. I., Togushova Yu.N., Gavrichkov V. A., Korshunov M. M.
Заглавие : Magnetic mechanisms of pairing in strongly correlated electron system of copper oxides [Electronic resource]
Место публикации : arXiv. - 2015. - Ст.eprint arXiv:1510.08640
Примечания : Cited References: 214. - The authors acknowledge support from FCP Scientific and Research-and-Educational Personnel of Innovative Russia for 2009-2013 (GK 16.740.12.0731 and GK 16.740.11.0740), RFBR (Grants 12-02-31534 and 12-02-31597), Siberian Federal University (Theme #F-11), Governmental support of leading scientific schools of Russia (NSh-1044.2012.2), Program of SB RAS #44, Presidium of RAS program #20.7. EIS, IAM, and MMK are grateful to The Dynasty Foundation and ICFPM forthe financial supportIn book.: Recent advances in superconductivity research", ed. by C.B. Taylor, 321 p., Nova Science Publishers Inc. New York, 2013 ISBN: 978-1-62618-406-0, Chapter 6
Предметные рубрики: Condensed matter-- Strongly correlated electrons
Superconductivity
Ключевые слова (''Своб.индексиров.''): strong electronic correlations--cuprates--hubbard operators--electronic structure--quantum phase transitions--magnetic mechanism of pairing
Аннотация: The multielectron LDA+GTB approach has been developed to calculate electronic structure of strongly correlated cuprates. At low energies the effective Hamiltonian of the t−t′−t"−t⊥−J∗−J⊥-model has been derived with parameters coming from the ab initio calculation for LSCO. The electronic structure of LSCO has been calculated self-consistently with the short-range antiferromagnetic order for various doping level. Two Lifshitz-type quantum phase transitions with Fermi surface topology changes have been found at dopings xc1=0.15 and xc2=0.24. Its effect on normal and superconducting properties has been calculated. The interatomic exchange parameter and its pressure dependence has been calculated within LDA+GTB scheme. The magnetic mechanisms of d-wave pairing induced by static and dynamical spin correlations are discussed. Simultaneous treatment of magnetic and phonon pairing results in the conclusion that both contributions are of the same order. For two layer cuprates like YBCO the interlayer hopping and exchange effects on the electronic structure and doping dependence of Tc is discussed as well as the Coulomb interaction induced mechanism of pairing.
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