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Orbital Selective Localization Enhancement in Ca2 – xSrxRuO4. / Shorikov, A. O.; Novoselov, D. Y.; Korotin, D. M. и др.
в: JETP Letters, Том 116, № 11, 2022, стр. 798-803.

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@article{b34497e78d1f4359b04705d9ce445ecf,
title = "Orbital Selective Localization Enhancement in Ca2 – xSrxRuO4",
abstract = "The combination of density functional theory with dynamic mean field theory (DFT + DMFT) was applied for the investigation of the magnetic properties of Ca2 –xSrxRuO4. We found that crystal structure distortion results in orbital-selective enhancement of the degree of localization of Ru d-electrons. The electron lifetime on dxy and dxz,yz orbitals differs by ≈5–6 times confirming the model of orbital-selective Mott transition. The change in the Hund exchange parameter JH from 0.5 to 0.9 eV for doping x = 0.5 increases localization degree by ≈3 times but does not destroy orbital-selective behavior which manifests itself more distinctly for smaller JH value. {\textcopyright} 2022, Pleiades Publishing, Inc.",
author = "Shorikov, {A. O.} and Novoselov, {D. Y.} and Korotin, {D. M.} and Anisimov, {V. I.}",
note = "This work was supported by of the Ministry of Science and Higher Education of the Russian Federation (state assignment no. 122021000039-4, theme Electron, DFT calculations) and by the Russian Science Foundation (project no. 19-12-00012, DMFT calculations).",
year = "2022",
doi = "10.1134/S0021364022602391",
language = "English",
volume = "116",
pages = "798--803",
journal = "JETP Letters",
issn = "0021-3640",
publisher = "Pleiades Publishing",
number = "11",

}

RIS

TY - JOUR

T1 - Orbital Selective Localization Enhancement in Ca2 – xSrxRuO4

AU - Shorikov, A. O.

AU - Novoselov, D. Y.

AU - Korotin, D. M.

AU - Anisimov, V. I.

N1 - This work was supported by of the Ministry of Science and Higher Education of the Russian Federation (state assignment no. 122021000039-4, theme Electron, DFT calculations) and by the Russian Science Foundation (project no. 19-12-00012, DMFT calculations).

PY - 2022

Y1 - 2022

N2 - The combination of density functional theory with dynamic mean field theory (DFT + DMFT) was applied for the investigation of the magnetic properties of Ca2 –xSrxRuO4. We found that crystal structure distortion results in orbital-selective enhancement of the degree of localization of Ru d-electrons. The electron lifetime on dxy and dxz,yz orbitals differs by ≈5–6 times confirming the model of orbital-selective Mott transition. The change in the Hund exchange parameter JH from 0.5 to 0.9 eV for doping x = 0.5 increases localization degree by ≈3 times but does not destroy orbital-selective behavior which manifests itself more distinctly for smaller JH value. © 2022, Pleiades Publishing, Inc.

AB - The combination of density functional theory with dynamic mean field theory (DFT + DMFT) was applied for the investigation of the magnetic properties of Ca2 –xSrxRuO4. We found that crystal structure distortion results in orbital-selective enhancement of the degree of localization of Ru d-electrons. The electron lifetime on dxy and dxz,yz orbitals differs by ≈5–6 times confirming the model of orbital-selective Mott transition. The change in the Hund exchange parameter JH from 0.5 to 0.9 eV for doping x = 0.5 increases localization degree by ≈3 times but does not destroy orbital-selective behavior which manifests itself more distinctly for smaller JH value. © 2022, Pleiades Publishing, Inc.

UR - http://www.scopus.com/inward/record.url?partnerID=8YFLogxK&scp=85142931264

UR - https://gateway.webofknowledge.com/gateway/Gateway.cgi?GWVersion=2&SrcAuth=tsmetrics&SrcApp=tsm_test&DestApp=WOS_CPL&DestLinkType=FullRecord&KeyUT=000890112300002

UR - https://elibrary.ru/item.asp?id=59831025

U2 - 10.1134/S0021364022602391

DO - 10.1134/S0021364022602391

M3 - Article

VL - 116

SP - 798

EP - 803

JO - JETP Letters

JF - JETP Letters

SN - 0021-3640

IS - 11

ER -

ID: 33991086