Библиотека института физики им. Л.В. Киренского СО РАН

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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Begunovich L. V., Kovaleva E. A., Korshunov M. M., Shabanov V. F.
Заглавие : Absorption spectra of the purple nonsulfur bacteria light-harvesting complex: A DFT study of the B800 part
Колич.характеристики :7 с
Место публикации : J. Photochem. Photobiol. A: Chem. - 2024. - Vol. 450. - Ст.115454. - ISSN 10106030 (ISSN), DOI 10.1016/j.jphotochem.2023.115454. - ISSN 18732666 (eISSN)
Примечания : Cited References: 42. - This work was supported by the state assignment of the Ministry of Science and Higher Education of the Russian Federation. Authors would like to thank Information Technology Centre, Novosibirsk State University for providing access to their supercomputers. L.V.B. would like to thank Irkutsk Supercomputer Center of SB RAS for providing the access to HPC-cluster «Akademik V.M. Matrosov» (Irkutsk Supercomputer Center of SB RAS, Irkutsk: ISDCT SB RAS; http://hpc.icc.ru, accessed 20.10.2023)
Аннотация: We’ve studied the B800 part of Rhodoblastus acidophilus light-harvesting complex (LH2) by several quantum chemical techniques based on the density functional theory (DFT) and determined the specific method and a minimal reliable model suitable for further studies of the LH2. In addition to bacteriochlorophyll a molecules, the minimal model includes two α and one β chain amino acids. Within the model, we are able to reproduce the contribution of the B800 ring of nine bacteriochlorophyll a molecules to the near infrared Qy absorption band. We also discuss the use of hybrid DFT calculations for precise energy and optical estimations and DFT-based tight binding (DFTB) method for the large-scale calculations. Crucial importance of Hartree-Fock exchange interaction for the correct description of B800 peak position was shown.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Kemper A. F., Korshunov M. M., Devereaux T. P., Fry J. N., Cheng H. P., Hirschfeld P. J.
Заглавие : Anisotropic quasiparticle lifetimes in Fe-based superconductors
Место публикации : Phys. Rev. B: AMER PHYSICAL SOC, 2011. - Vol. 83, Is. 18. - Ст.184516. - ISSN 1098-0121, DOI 10.1103/PhysRevB.83.184516
Примечания : Cited References: 43. - We thank O. Dolgov, R. Hackl, D. Maslov, I. Mazin, B. Muschler, V. Mishra, and J. Schmalian for useful discussions. A. F. K. and T. P. D. thank the Walther MeiBner Institut for their hospitality. A. F. K., M. M. K., and P. J. H. acknowledge support from DOE Grant No. DE-FG02-05ER46236. M. M. K. acknowledges support from RFBR (Grant No. 09-02-00127), Presidium of RAS program "Quantum physics of condensed matter" N5.7, FCP Scientific and Research-and-Educational Personnel of Innovative Russia for 2009-2013 (GK P891), and President of Russia (Grant No. MK-1683.2010.2). A. F. K. and T. P. D. acknowledge support from DOE Grant No. DE-AC02-76SF00515. H.-P. C. and J.N.F. acknowledge DOE/BES Grant No. DE-FG02-02ER45995.
Предметные рубрики: ELECTRONIC RAMAN-SCATTERING
Аннотация: We study the dynamical quasiparticle scattering by spin and charge fluctuations in Fe-based pnictides within a five-orbital model with on-site interactions. The leading contribution to the scattering rate is calculated from the second-order diagrams with the polarization operator calculated in the random-phase approximation. We find one-particle scattering rates which are highly anisotropic on each Fermi surface sheet due to the momentum dependence of the spin susceptibility and the multiorbital composition of each Fermi pocket. This fact, combined with the anisotropy of the effective mass, produces disparity between electrons and holes in conductivity, the Hall coefficient, and the Raman initial slope, in qualitative agreement with experimental data.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Cao G. X., Korshunov M. M., Gao Y. Z., Le Tacon M., Singh D. J., Lin C. T.
Заглавие : Anomalous in-plane electronic scattering in charge ordered Na 0.41CoO 2•0.6H 2O
Место публикации : Phys. Rev. Lett.: American Physical Society, 2012. - Vol. 108, Is. 23. - Ст.236401. - ISSN 0031-9007, DOI 10.1103/PhysRevLett.108.236401
Примечания : Cited References: 41. - We thank H. Habermeier, D. Mandrus, B. C. Sales, I. Eremin, I. I. Mazin, and P. J. Hirschfeld for useful discussions. G. Cao acknowledges support from NSFC (No. 10804068, 10774097). M. M. K. acknowledges support from RFBR (Grant No. 09-02-00127), Presisium of RAS program "Quantum physics of condensed matter" N5.7, Integration Grant of SBRAS-UrBRAS N40, and Russian FCP (GK 16.740.12.0731), and The Dynasty Foundation and ICFPM. Work at ORNL was supported by the Department of Energy, BES, Materials Science and Engineering Division.
Предметные рубрики: SUPERCONDUCTIVITY
TRIPLET
FLUCTUATIONS
IONS
Аннотация: We report electronic transport measurements on high quality floating zone grown NaxCoO2 and Na0.41CoO2·0.6H2O single crystals. We find an in-plane electronic scattering minimum near 11 K and a clear charge ordering at approximately 50 K. The electronic and magnetic properties in hydrated and nonhydrated Na0.41CoO2 samples are similar at higher temperature, but evolve in markedly different ways below ∼50 K, where a strong ferromagnetic tendency is observed in the hydrated sample. Model calculations show the relationship of this tendency to the structure of the Fermi surface. The results, particularly the clear differences between the hydrated and nonhydrated material show a substantially enhanced ferromagnetic tendency upon hydration. Implications for superconductivity are discussed.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Korshunov M. M., Ovchinnikov S. G., Gavrichkov V. A., Nekrasov I. A., Pchelkina Z. V., Anisimov V. I.
Заглавие : Application of the new LDA plus GTB method for the band structure calculation of n-type cuprates
Разночтения заглавия :авие SCOPUS: Application of the new LDA+GTB method for the band structure calculation of n-type cuprates
Место публикации : Physica B: ELSEVIER SCIENCE BV, 2006. - Vol. 378-80: International Conference on Strongly Correlated Electron Systems (SECES 05) (JUL 26-30, 2005, Vienna, AUSTRIA). - P459-460. - ISSN 0921-4526, DOI 10.1016/j.physb.2006.01.340
Примечания : Cited References: 11
Предметные рубрики: SUPERCONDUCTIVITY
PARAMETERS
DENSITY
Ключевые слова (''Своб.индексиров.''): strongly correlated electron systems--superconductivity--n-type cuprates--n-type cuprates--strongly correlated electron systems--superconductivity--electronic structure--hamiltonians--mathematical models--oxide superconductors--perturbation techniques--intercluster hopping--n-type cuprates--strongly correlated electron systems--band structure
Аннотация: A novel hybrid scheme is proposed and applied for band structure calculations of undoped n-type cuprate Nd2CuO4. The ab initio LDA calculation is used to obtain single electron and Coulomb parameters of the multiband Hubbard-type model. In strong correlation regime the electronic structure within this model is calculated by the generalized tight-binding (GTB) method, that combines the exact diagonalization of the model Hamiltonian for a small cluster with perturbation treatment of the intercluster hopping and interactions. For Nd2CuO4, this scheme results in charge transfer insulator with value of the gap and band dispersion in agreement to the experimental data. (c) 2006 Elsevier B.V. All rights reserved.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Slobodchikov A. A., Nekrasov I. A., Pavlov N. S., Korshunov M. M.
Заглавие : Article simplicity out of complexity: Band structure for w20o58 superconductor
Место публикации : Nanomaterials. - 2021. - Vol. 11, Is. 1. - Ст.97. - P.1-10. - ISSN 20794991 (ISSN), DOI 10.3390/nano11010097
Примечания : Cited References: 31. - This work was supported in part by RFBR grants No. 18-02-00281, 20-02-00011 (IAN, NSP, AAS), by RFBR and Government of Krasnoyarsk Territory and Krasnoyarsk Regional Fund of Science to the Research Projects “Electronic correlation effects and multiorbital physics in iron-based materials and cuprates” grant No. 19-42-240007 (MMK), and by the Program of Ministry of Education and Science of the Russian Federation No. 2020-1902-01-239. NSP work was also supported in part by the President of Russia grant for young scientists No. MK-1683.2019.2
Аннотация: The band structure, density of states, and the Fermi surface of a recently discovered superconductor, oxygen-deficient tungsten oxide WO2.9 that is equivalent to W20O58, is studied within the density functional theory (DFT) in the generalized gradient approximation (GGA). Here we show that despite the extremely complicated structure containing 78 atoms in the unit cell, the low-energy band structure is quite feasible. Fermi level is crossed by no more than 10 bands per one spin projection (and even 9 bands per pseudospin projection when the spin-orbit coupling is considered) originating from the t2g 5d-orbitals of tungsten atoms forming zigzag chains. These bands become occupied because of the specific zigzag octahedra distortions. To demonstrate the role of distortions, we compare band structures of W20O58 with the real crystal structure and with the idealized one. We also propose a basis for a minimal low-energy tight-binding model for W20O58.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Korshunov M. M., Togushova Yu.N.
Заглавие : Band structure modification due to the spin-orbit coupling in the three-orbital model for iron pnictides
Коллективы : Russian Foundation for Basic Research [16-02-00098]; BASIS Foundation for Development of Theoretical Physics and Mathematics
Место публикации : J. Sib. Fed. Univ. Math. Phys. - 2018. - Vol. 11, Is. 4. - P.430-437. - ISSN 1997-1397, DOI 10.17516/1997-1397-2018-11-4-430-437; Журн. СФУ. Сер. "Математика и физика". - ISSN 2313-6022(eISSN)
Примечания : Cited References: 14. - This work was supported in part by the Russian Foundation for Basic Research (grant 16-02-00098) and BASIS Foundation for Development of Theoretical Physics and Mathematics.
Предметные рубрики: SUPERCONDUCTING STATE
Ключевые слова (''Своб.индексиров.''): fe-based superconductors--spin-orbit coupling--band structure--fermi surface--сверхпроводники на основе железа--спин-орбитальное взаимодействие--зонная структура--поверхность ферми
Аннотация: We study the effect of the spin-orbit coupling on the band structure and the Fermi surface of the three-orbital model within the two-iron Brillouin zone. Due to the presence of two irons in the crystallographically correct unit cell, the spin-orbit coupling can be divided into the intra- and intercell parts with respect to the one-iron unit cell. We show that the intercell part produces the reconstruction of the Fermi surface in the form of the pronounced splitting between the previously degenerate electron (π, π)-pockets along the (0, π) - (π, π) direction. Intracell part shifts the bands around (0, 0) point and removes degeneracy there. There are also some other band shifts but they should not affect the low-energy physics because they occur at energy scales of about 1 eV below the Fermi level.Исследовано влияние спин-орбитального взаимодействия на зонную сруктуру и поверхность Ферми трехорбитальной модели в зоне Бриллюэна двух атомов железа на ячейку. Из-за присутствия двух атомов железа в кристаллографической элементарной ячейке спин-орбитальное взаимодействие можно разделить на внутри- и межъячеечную части по отношению к элементарной ячейке решетки железа. Показано, что межъячеечная часть приводит к реконструкции поверхности Ферми в виде выраженного расщепления между ранее вырожденными электронными карманами в точке (π ;π ) вдоль направления (0; π) − (π; π). Внутриячеечная часть приводит к сдвигу зон вблизи точки (0; 0) и снимает там вырождение. Также имеют место другие сдвиги зон, но они не должны влиять на низкоэнергетическую физику, поскольку возникают на энергиях порядка 1 eV ниже уровня Ферми.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Begunovich L. V., Korshunov M. M.
Заглавие : Band structure of organic-ion-intercalated (EMIM)xFeSe superconductor
Место публикации : Materials. - 2022. - Vol. 15, Is. 5. - Ст.1856. - ISSN 19961944 (ISSN), DOI 10.3390/ma15051856
Примечания : Cited References: 62. - This work was supported in part by Russian Science Foundation (Project 19-73-10015)
Аннотация: The band structure and the Fermi surface of the recently discovered superconductor (EMIM)xFeSe are studied within the density functional theory in the generalized gradient approximation. We show that the bands near the Fermi level are formed primarily by Fe-d orbitals. Although there is no direct contribution of EMIM orbitals to the near-Fermi level states, the presence of organic cations leads to a shift of the chemical potential. It results in the appearance of small electron pockets in the quasi-two-dimensional Fermi surface of (EMIM)xFeSe.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Korshunov M. M., Nekrasov I. A., Pavlov N. S., Slobodchikov A. A.
Заглавие : Band structure of tungsten oxide W20O58 with ideal octahedra
Место публикации : JETP Letters. - 2021. - Vol. 113, Is. 1. - P.57-60. - ISSN 00213640 (ISSN), DOI 10.1134/S0021364021010057
Примечания : Cited References: 38. - This work was supported by the Russian Foundation for Basic Research, the Government of Krasnoyarsk Territory, and Krasnoyarsk Regional Fund of Science (project no. 19-42-240007 “Electronic Correlation Effects and Multiorbital Physics in Iron-Based Materials and Cuprates,” M.M.K.), by the Russian Foundation for Basic Research (project nos. 18-02-00281 and 20-02-00011, I.A.N., N.S.P., A.A.S.), and by the of the President of the Russian Federation for State Support of Young Scientists and Leading Scientific Schools (project no. MK-1683.2019.2, N.S.P. and A.A.S.)
Аннотация: The band structure, density of states, and the Fermi surface of a tungsten oxide WO2.9 with idealized crystal structure (ideal octahedra WO6 creating a “square lattice”) is obtained within the density functional theory in the generalized gradient approximation. Because of the oxygen vacancies ordering this system is equivalent to the compound W20O58 (Magneli phase), which has 78 atoms in unit cell. We show that 5d-orbitals of tungsten atoms located immediately around the voids in the zigzag chains of edge-sharing octahedra give the dominant contribution near the Fermi level. These particular tungsten atoms are responsible of low-energy properties of the system.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Ivanov D. A., Togushova Y. N., Korshunov M. M.
Заглавие : Changes of the Fermi surface topology in the three-orbital model for iron pnictides with the spin-orbit coupling
Колич.характеристики :9 с
Место публикации : J. Sib. Fed. Univ. Math. Phys. - 2023. - Vol. 16, Is. 6. - P.795-803. - ISSN 19971397 (ISSN); Журн. СФУ. Матем. и физ. - ISSN 23136022 (eISSN)
Примечания : Cited References: 28
Аннотация: Effect of the spin-orbit coupling on the band structure and the Fermi surface of the three-orbital model is studied. The inter-orbital part of the model is reformulated to fully conform with the iron lattice symmetry. Because there are two iron ions in the unit cell, we introduce the intra-and inter-ion spin-orbit coupling constants to separate the effect of the related couplings on the band structure and the Fermi surface. Both the intra-and inter-ion parts lift the degeneracy of some bands at the Γ = (0, 0) point and the splitting of bands along the (0, π) ‒ (π, π) direction of the Brillouin zone. We show that the inter-ion part of the spin-orbit coupling leads to the topological change of the Fermi surface — the splitting of two Fermi surface sheets around the M = (π, π) point.Изучено влияние спин-орбитального взаимодействия на зонную структуру и поверхность Ферми в трехорбитальной модели. Межорбитальная часть модели изменена для полного соответствия с симметрией решетки железа. Из-за наличия двух ионов железа в элементарной ячейке мы вводим внутри- и межионную константы спин-орбитального взаимодействия для разделения эффектов соответствующих взаимодействий на зонную структуру и поверхность Ферми. И внутри, и межионная части снимают вырождение некоторых зон в точке Γ = (0, 0) и вырождение вдоль направления (0, π) − (π, π) зоны Бриллюэна. Показано, что межионная часть спин-орбитального взаимодействия приводит к изменению топологии поверхности Ферми, а именно к разделению листов поверхности Ферми вблизи точки M = (π, π).
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10.

Вид документа : Статья из сборника (однотомник)
Шифр издания :
Автор(ы) : Korshunov M. M., Nikolaev S. V., Togushova Yu. N.
Заглавие : Cluster perturbation approach to iron-based superconductors
Коллективы : Quantum in Complex Matter: Superconductivity, Magnetism and Ferroelectricity, International conference
Место публикации : Quant. in Complex Matter: Supercond., Magnet. and Ferroelectr.: book of abstracts/ ed. A. Bianconi. - Rome, 2016. - P.148. - ISBN 978-88-6683-055-9
Примечания : References: 8. - This work was partially supported by the RFBR (grant 16-02-00098)
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11.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Klauss H. H., Luetkens H., Klingeler R., Hess C., Litterst F. J., Kraken M., Korshunov M. M., Eremin I., Drechsler S. L., Khasanov R., Amato A., Hamann-Borrero J. E., Leps N., Kondrat A., Behr G., Werner J., Buchner B.
Заглавие : Commensurate spin density wave in LaFeAsO: A local probe study
Место публикации : Phys. Rev. Lett.: AMER PHYSICAL SOC, 2008. - Vol. 101, Is. 7. - Ст.77005. - ISSN 0031-9007, DOI 10.1103/PhysRevLett.101.077005
Примечания : Cited References: 28
Предметные рубрики: LAYERED QUATERNARY COMPOUND
SUPERCONDUCTIVITY
Ключевые слова (''Своб.индексиров.''): arsenic compounds--chlorine compounds--ferromagnetism--magnetic materials--magnetic properties--magnetization--magnets--molybdenum--phase transitions--spin density waves--commensurate spin density wave--external fields--magnetic orders--muon spin relaxations--order parameter--ordered moments--probe measurements--ssbauer spectroscopy--structural phase transition--sublattice magnetizations--temperature dependences--spin dynamics
Аннотация: We present a detailed study on the magnetic order in the undoped mother compound LaFeAsO of the recently discovered Fe-based superconductor LaFeAsO(1-x)F(x). In particular, we present local probe measurements of the magnetic properties of LaFeAsO by means of (57)Fe Mossbauer spectroscopy and muon-spin relaxation in zero external field along with magnetization and resistivity studies. These experiments prove a commensurate static magnetic order with a strongly reduced ordered moment of 0.25(5)mu(B) at the iron site below T(N)=138 K, well separated from a structural phase transition at T(S)=156 K. The temperature dependence of the sublattice magnetization is determined and compared to theory. Using a four-band spin density wave model both, the size of the order parameter and the quick saturation below T(N) are reproduced.
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12.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Korshunov M. M., Shestakov V. A., Togushova, Yu. N.
Заглавие : Comparison of experimental data on the spin resonance frequency and gap magnitudes in Fe-based superconductors
Коллективы : Euro-Asian Symposium "Trends in MAGnetism", "Trends in MAGnetism", Euro-Asian Symposium, Институт физики им. Л.В. Киренского Сибирского отделения РАН , RFBR [16-02-00098]; Government Support of the Leading Scientific Schools of the Russian Federation [NSh-7559.2016.2]
Место публикации : J. Magn. Magn. Mater.: Elsevier Science, 2017. - Vol. 440: EURO-Asian Symposium on Trends in Magnetism (EASTMAG) (AUG 15-19, 2016, Siberian Fed Univ, Krasnoyarsk, RUSSIA). - P.133-135. - ISSN 0304-8853, DOI 10.1016/j.jmmm.2016.12.082. - ISSN 1873-4766(eISSN)
Примечания : Cited References:73. - We would like to thank H. Kontani, S.A. Kuzmichev, T.E. Kuzmicheva, and V.M. Pudalov for useful discussions. We acknowledge partial support by RFBR (Grant 16-02-00098), and Government Support of the Leading Scientific Schools of the Russian Federation (NSh-7559.2016.2).
Предметные рубрики: RESOLVED PHOTOEMISSION-SPECTROSCOPY
INELASTIC NEUTRON-SCATTERING
Ключевые слова (''Своб.индексиров.''): fe-based superconductors--inelastic neutron scattering--unconventional--superconductivity--magnetic mechanism of pairing
Аннотация: Here we review experimental data on the peak in inelastic neutron scattering (INS) and superconducting gaps extracted from various experimental techniques. Comparison of energy scales gives the confidence that the observed peak in INS for most materials is the true spin resonance.
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13.

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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14.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Shestakov V. A., Korshunov M. M., Togushova Yu. N., Dolgov, O., V
Заглавие : Decisive proofs of the s± → s++ transition in the temperature dependence of the magnetic penetration depth
Коллективы : Russian Foundation for Basic Research (RFBR)Russian Foundation for Basic Research (RFBR) [19-32-90109]; RFBRRussian Foundation for Basic Research (RFBR); Government of Krasnoyarsk Territory; Krasnoyarsk Regional Fund of Science to the Research Projects 'Electronic correlation effects and multiorbital physics in iron-based materials and cuprates' [19-42-240007]
Место публикации : Supercond. Sci. Technol. - 2021. - Vol. 34, Is. 7. - Ст.075008. - ISSN 0953-2048, DOI 10.1088/1361-6668/abff6f. - ISSN 1361-6668(eISSN)
Примечания : Cited References: 40. - We are grateful to D V Efremov, A S Fedorov, S G Ovchinnikov, E I Shneyder, D Torsello, and A N Yaresko for useful discussions. This work was supported in part by the Russian Foundation for Basic Research (RFBR) Grant No. 19-32-90109 and by RFBR and Government of Krasnoyarsk Territory and Krasnoyarsk Regional Fund of Science to the Research Projects 'Electronic correlation effects and multiorbital physics in iron-based materials and cuprates' Grant No. 19-42-240007.
Предметные рубрики: ORDER-PARAMETER
IMPURITIES
SUPERCONDUCTORS
STATES
MODEL
Аннотация: One of the features of the unconventional s± state in iron-based superconductors is possibility to transform to the s++ state with the increase of the nonmagnetic disorder. Detection of such a transition would prove the existence of the s± state. Here we study the temperature dependence of the London magnetic penetration depth within the two-band model for the s± and s++ superconductors. By solving Eliashberg equations accounting for the spin-fluctuation mediated pairing and nonmagnetic impurities in the T-matrix approximation, we have derived a set of specific signatures of the s± → s++ transition: (1) sharp change in the behavior of the penetration depth λL as a function of the impurity scattering rate at low temperatures; (2) before the transition, the slope of ΔλL(T) = λL(T) - λL(0) increases as a function of temperature, and after the transition this value decreases; (3) the sharp jump in the inverse square of the penetration depth as a function of the impurity scattering rate, λL-2(Γa), at the transition; (4) change from the single-gap behavior in the vicinity of the transition to the two-gap behavior upon increase of the impurity scattering rate in the superfluid density ρs(T).
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15.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Shestakov V. A., Korshunov M. M., Togushova Yu.N., Efremov D. V., Dolgov O. V.
Заглавие : Details of the disorder-induced transition between s± and s++ states in the two-band model for Fe-based superconductors
Коллективы : Russian Foundation for Basic Research [16-02-00098]; Government Support of the Leading Scientific Schools of the Russian Federation [NSh-7559.2016.2]; 'BASIS' Foundation for Development of Theoretical Physics and Mathematics
Место публикации : Supercond. Sci. Technol. - 2018. - Vol. 31, Is. 3. - Ст.034001. - ISSN 0953-2048, DOI 10.1088/1361-6668/aaa501. - ISSN 1361-6668(eISSN)
Примечания : Cited References:62. - We are grateful to P D Grigor'ev and M V Sadovskii for useful discussions. This work was supported in part by the Russian Foundation for Basic Research (grant 16-02-00098) and Government Support of the Leading Scientific Schools of the Russian Federation (NSh-7559.2016.2). MMK and VAS acknowledge the support of the 'BASIS' Foundation for Development of Theoretical Physics and Mathematics.
Предметные рубрики: IRON-BASED SUPERCONDUCTORS
HIGH-TEMPERATURE SUPERCONDUCTIVITY
PAIRING
Ключевые слова (''Своб.индексиров.''): unconventional superconductors--iron pnictides--iron chalcogenides--impurity scattering
Аннотация: IIrradiation of superconductors with different particles is one of many ways to investigate the effects of disorder. Here we study the disorder-induced transition between s ± and s ++ states in the two-band model for Fe-based superconductors with nonmagnetic impurities. Specifically, we investigate the important question of whether the superconducting gaps during the transition change smoothly or abruptly. We show that the behavior can be of either type and is controlled by the ratio of intraband to interband impurity scattering potentials, and by a parameter σ, that represents scattering strength and ranges from zero (Born approximation) to one (unitary limit). For the pure interband scattering potential and the scattering strength σ ≲ 0.11, the s ± → s ++ transition is accompanied by steep changes in the gaps, while for larger values of σ, the gaps change smoothly. The behavior of the gaps is characterized by steep changes at low temperatures, T˂ 0.1Tc0 with Tc0 being the critical temperature in the clean limit, otherwise it changes gradually. The critical temperature Tc is always a smooth function of the scattering rate in spite of the steep changes in the behavior of the gaps.
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16.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Korshunov M. M., Kuzmichev S. A., Kuzmicheva T. E.
Заглавие : Direct observation of the spin exciton in Andreev spectroscopy of iron-based superconductors
Место публикации : Materials. - 2022. - Vol. 15, Is. 17. - Ст.6120. - ISSN 19961944 (ISSN), DOI 10.3390/ma15176120
Примечания : Cited References: 50. - All authors acknowledge support by the state assignment of the Ministry of Science and Higher Education of the Russian Federation, nos. 0023-2019-0005 and 0287-2021-0035
Аннотация: Quasiparticle excitations provide viable information on the physics of unconventional superconductors. Higgs and Leggett modes are some of the classic examples. Another important bosonic excitation is the spin exciton originating from the sign-changing superconducting gap structure. Here we report a direct observation of the temperature-dependent spin exciton in the Andreev spectra of iron-based superconductors. Combined with the other experimental evidence, our observation confirms the extended s-wave (s±) order parameter symmetry and indirectly proves the spin-fluctuation mechanism of Cooper pairing.
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17.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Efremov D. V., Korshunov M. M., Dolgov O. V., Golubov A. A., Hirschfeld P. J.
Заглавие : Disorder-induced transition between s(+/-) and s(++) states in two-band superconductors
Разночтения заглавия :авие SCOPUS: Disorder-induced transition between sВ± and s++ states in two-band superconductors
Место публикации : Phys. Rev. B: AMER PHYSICAL SOC, 2011. - Vol. 84, Is. 18. - Ст.180512. - ISSN 1098-0121, DOI 10.1103/PhysRevB.84.180512
Примечания : Cited References: 31. - The authors are grateful to S.-L. Drechsler, P. Fulde, I. I. Mazin, V. Mishra, and D. J. Scalapino for useful discussions. The present work was partially supported by the DFG Priority Programme SPP1458 (D.V.E.), Dutch FOM(A.A.G.), DOEDE-FG02-05ER46236 (P.J.H. and M.M.K.), and RFBR 09-02-00127, Presidium of RAS program N5.7, FCP GK P891, and GK 16.740.12.0731, and President of Russia MK-1683.2010.2 (M.M.K.). P.J.H. and M.M.K. are grateful for the support of the Kavli Institute for Theoretical Physics and the Stanford Institute for Materials & Energy Science during the writing of this work.
Предметные рубрики: HIGH-TEMPERATURE SUPERCONDUCTIVITY
IMPURITIES
DENSITY
Аннотация: We have reexamined the problem of disorder in two-band superconductors, and shown, within the framework of the T-matrix approximation, that the suppression of T-c can be described by a single parameter depending on the intraband and interband impurity scattering rates. T-c is shown to be more robust against nonmagnetic impurities than would be predicted in the trivial extension of Abrikosov-Gor'kov theory. We find a disorder-induced transition from the s(+/-) state to a gapless and then to a fully gapped s(++) state, controlled by a single parameter-the sign of the average coupling constant (lambda). We argue that this transition has strong implications for experiments.
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18.

Вид документа : Статья из сборника (однотомник)
Шифр издания :
Автор(ы) : Korshunov M. M., Efremov D. V., Dolgov O. V., Golubov A. A., Hirschfeld P. J.
Заглавие : Disorder-induced transition between s± and s++ states Fe-based superconductors
Коллективы : International Conference "APS". March Meeting 2012 , APS March Meeting (2012 ; 27 Feb.-2 March; Boston, Massachusetts, USA), American Physical Society March Meeting (2012 ; 27 Feb.-2 March; Boston, Massachusetts, USA)
Место публикации : International Conference "APS". March Meeting: bulletin of the American Physical Society. - 2012. - Vol. 57, № 1 . - P.113
Аннотация: The symmetry and structure of the superconducting gap in recently discovered Fe-based materials is one of the main challenges in this exciting new field (see, e.g. P.J. Hirschfeld, M.M. Korshunov, and I.I. Mazin, Rep. Progr. Phys. 2011). We have reexamined the problem of disorder in 2-band superconductors, and shown within the framework of the T-matrix approximation that the suppression of Tc can be described by a single parameter depending on the intra- and interband impurity scattering rates. Tc is shown to be more robust against nonmagnetic impurities than would be predicted in the trivial extension of Abrikosov-Gor'kov theory. We find disorder-induced transition from the s± state to a gapless and then to a fully gapped s++ state, controlled by the sign of the average coupling constant.
Материалы конференции,
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19.

Вид документа : Статья из сборника (однотомник)
Шифр издания :
Автор(ы) : Dolgov O. V., Korshunov M. M., Golubov A. A., Efremov D. V.
Заглавие : Does magnetic scattering always suppress superconducting transition?
Коллективы : Euro-Asian Symposium "Trends in MAGnetism", "Trends in MAGnetism", Euro-Asian Symposium, Институт физики им. Л.В. Киренского Сибирского отделения РАН
Место публикации : VI Euro-Asian Symposium "Trends in MAGnetism" (EASTMAG-2016): abstracts/ ed.: O. A. Maksimova, R. D. Ivantsov. - Krasnoyarsk: KIP RAS SB, 2016. - Ст.I2.5. - P.125. - ISBN 978-5-904603-06-9 (Шифр -478014040)
Примечания : We acknowledge partial support by RFBR (Grant RFBR 16-02-00098)
Ключевые слова (''Своб.индексиров.''): unconventional superconductivity--impurities, pnictides --multiband systems
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20.

Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Korshunov M. M., Gavrichkov V. A., Ovchinnikov S. G., Nekrasov I. A., Kokorina E. E., Pchelkina Z. V.
Заглавие : Dominance of many-body effects over the one-electron mechanism for band structure doping dependence in Nd2-xCexCuO4: the LDA + GTB approach
Разночтения заглавия :авие SCOPUS: Dominance of many-body effects over the one-electron mechanism for band structure doping dependence in Nd2-xCexCuO4: The LDA+GTB approach
Место публикации : J. Phys.: Condens. Matter: IOP PUBLISHING LTD, 2007. - Vol. 19, Is. 48. - Ст.486203. - ISSN 0953-8984, DOI 10.1088/0953-8984/19/48/486203
Примечания : Cited References: 36
Предметные рубрики: NARROW ENERGY BANDS
HUBBARD-MODEL
SUPERCONDUCTORS
DENSITY
TEMPERATURE
ORBITALS
WAVE
Ключевые слова (''Своб.индексиров.''): antiferromagnetism--band structure--correlation methods--crystal structure--local density approximation--superconducting materials--electronic correlations--fermionic quasiparticles--neodymium compounds
Аннотация: In the present work we report band structure calculations for the high-temperature superconductor Nd2-xCexCuO4 in the regime of strong electronic correlations within an LDA + GTB method, which combines the local density approximation (LDA) and the generalized tight-binding method (GTB). The two mechanisms of band structure doping dependence were taken into account. Namely, the one-electron mechanism provided by the doping dependence of the crystal structure, and the many-body mechanism provided by the strong renormalization of the fermionic quasiparticles due to the large on-site Coulomb repulsion. We have shown that, in the antiferromagnetic and in the strongly correlated paramagnetic phases of the underdoped cuprates, the main contribution to the doping evolution of the band structure and Fermi surface comes from the many-body mechanism.
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