ISSN: 2310-757X
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http://elar.urfu.ru/handle/10995/131250Полная запись метаданных
| Поле DC | Значение | Язык |
|---|---|---|
| dc.contributor.author | Shorikov, A. O. | en |
| dc.date.accessioned | 2024-04-08T11:06:00Z | - |
| dc.date.available | 2024-04-08T11:06:00Z | - |
| dc.date.issued | 2022 | - |
| dc.identifier.citation | Shorikov, AO 2022, 'Theoretical Modeling of High Spin to Low Spin Transition and Structural Stability Under Pressure in CaFeO3', JETP Letters, Том. 116, № 9, стр. 634-637. https://doi.org/10.1134/S0021364022601993 | harvard_pure |
| dc.identifier.citation | Shorikov, A. O. (2022). Theoretical Modeling of High Spin to Low Spin Transition and Structural Stability Under Pressure in CaFeO3. JETP Letters, 116(9), 634-637. https://doi.org/10.1134/S0021364022601993 | apa_pure |
| dc.identifier.issn | 0021-3640 | - |
| dc.identifier.other | Final | 2 |
| dc.identifier.other | All Open Access; Hybrid Gold Open Access | 3 |
| dc.identifier.other | https://link.springer.com/content/pdf/10.1134/S0021364022601993.pdf | 1 |
| dc.identifier.other | https://link.springer.com/content/pdf/10.1134/S0021364022601993.pdf | |
| dc.identifier.uri | http://elar.urfu.ru/handle/10995/131250 | - |
| dc.description.abstract | Evolution of magnetic and spectral properties and structure stability of CaFeO3 are investigated in frames of the GGA + U method. It is shown that the GGA + U method is able to reproduce the transition from high spin to low spin under pressure obtained experimentally. At ambient pressure monoclinic structure has lower energy which agrees with experiment. Full structural relaxation shows that orthorhombic structure in unstable above 30 GPa and undergoes a distortion toward monoclinic structure. © 2022, The Author(s). | en |
| dc.format.mimetype | application/pdf | en |
| dc.language.iso | en | en |
| dc.publisher | Pleiades Publishing | en |
| dc.rights | info:eu-repo/semantics/openAccess | en |
| dc.rights | cc-by | other |
| dc.rights.uri | https://creativecommons.org/licenses/by/4.0/ | unpaywall |
| dc.source | JETP Letters | 2 |
| dc.source | JETP Letters | en |
| dc.title | Theoretical Modeling of High Spin to Low Spin Transition and Structural Stability Under Pressure in CaFeO3 | en |
| dc.type | Article | en |
| dc.type | info:eu-repo/semantics/article | en |
| dc.type | info:eu-repo/semantics/publishedVersion | en |
| dc.identifier.rsi | 52025743 | - |
| dc.identifier.doi | 10.1134/S0021364022601993 | - |
| dc.identifier.scopus | 85140591669 | - |
| local.contributor.employee | Shorikov A.O., Mikheev Institute of Metal Physics, Ural Branch, Russian Academy of Sciences, Yekaterinburg, 620108, Russian Federation, Department of Theoretical Physics and Applied Mathematics, Ural Federal University, Yekaterinburg, 620002, Russian Federation | en |
| local.description.firstpage | 634 | - |
| local.description.lastpage | 637 | - |
| local.issue | 9 | - |
| local.volume | 116 | - |
| dc.identifier.wos | 000871841700003 | - |
| local.contributor.department | Mikheev Institute of Metal Physics, Ural Branch, Russian Academy of Sciences, Yekaterinburg, 620108, Russian Federation | en |
| local.contributor.department | Department of Theoretical Physics and Applied Mathematics, Ural Federal University, Yekaterinburg, 620002, Russian Federation | en |
| local.identifier.pure | 32891311 | - |
| local.identifier.pure | ab882509-5d51-4f5a-8e22-76f7a9c3635e | uuid |
| local.identifier.eid | 2-s2.0-85140591669 | - |
| local.identifier.wos | WOS:000871841700003 | - |
| Располагается в коллекциях: | Научные публикации ученых УрФУ, проиндексированные в SCOPUS и WoS CC | |
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| Файл | Описание | Размер | Формат | |
|---|---|---|---|---|
| 2-s2.0-85140591669.pdf | 543,2 kB | Adobe PDF | Просмотреть/Открыть |
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