The Linear Muffin-Tin Orbitals/Tight-Binding/Direct-Screening Method for the Calculation of the Electronic Structure of Crystals Научная публикация
Журнал |
Journal of Physics Condensed Matter
ISSN: 0953-8984 , E-ISSN: 1361-648X |
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Вых. Данные | Год: 1992, Том: 4, Номер: 4, Страницы: 1069-1080 Страниц : 12 DOI: 10.1088/0953-8984/4/4/017 | ||||
Авторы |
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Организации |
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Информация о финансировании (1)
1 | Правительство Российской Федерации | 198 |
Реферат:
A new version of the tight-binding representation of the linear muffin-tin orbitals method based on the direct-screening of the muffin-tin orbitals (LMTO-TB-DS) is presented. The equations for the screened basis wavefunctions, the screened structure matrix and the corresponding Hamiltonian are obtained. Test calculations of the chromium and YBa2Cu3O7 band structures proved the validity and accuracy of the method.
Библиографическая ссылка:
Borovskoi E.M.
, Kraftmakher A.Y.
, Tapilin V.M.
The Linear Muffin-Tin Orbitals/Tight-Binding/Direct-Screening Method for the Calculation of the Electronic Structure of Crystals
Journal of Physics Condensed Matter. 1992. V.4. N4. P.1069-1080. DOI: 10.1088/0953-8984/4/4/017 WOS Scopus РИНЦ
The Linear Muffin-Tin Orbitals/Tight-Binding/Direct-Screening Method for the Calculation of the Electronic Structure of Crystals
Journal of Physics Condensed Matter. 1992. V.4. N4. P.1069-1080. DOI: 10.1088/0953-8984/4/4/017 WOS Scopus РИНЦ
Даты:
Поступила в редакцию: | 27 мар. 1991 г. |
Принята к публикации: | 16 июл. 1991 г. |
Опубликована в печати: | 27 янв. 1992 г. |
Опубликована online: | 1 янв. 1999 г. |
Идентификаторы БД:
Web of science | WOS:A1992HC70900017 |
Scopus | 2-s2.0-0343839981 |
РИНЦ | 31142082 |
Chemical Abstracts | 1992:113756 |
Chemical Abstracts (print) | 116:113756 |
OpenAlex | W2004005881 |