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    Academic Journal

    Contributors: The research was carried out using the infrastructure of the Shared Research Facilities «High Performance Computing and Big Data» (CKP «Informatics») of FRC CSC RAS (Moscow). The authors are grateful to Dr. Sci. (Phys.-Math.), Prof. A.G. Italiantsev, for setting the problem and constant consultations on the topic of the study., Работа выполнялась с использованием инфраструктуры Центра коллективного пользования «Высокопроизводительные вычисления и большие данные» (ЦКП «Информатика») ФИЦ ИУ РАН (г. Москва). Авторы выражают благодарность д.ф.-м.н., профессору А.Г. Итальянцеву за постановку задачи и постоянные консультации по теме исследования.

    Source: Izvestiya Vysshikh Uchebnykh Zavedenii. Materialy Elektronnoi Tekhniki = Materials of Electronics Engineering; Том 26, № 3 (2023); 198-203 ; Известия высших учебных заведений. Материалы электронной техники; Том 26, № 3 (2023); 198-203 ; 2413-6387 ; 1609-3577 ; 10.17073/1609-3577-2023-3

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    Relation: https://met.misis.ru/jour/article/view/553/443; Shaw T.M., Trolier-McKinstry S., McIntyre P.C. The properties of ferroelectric films at small dimensions. Annual Review of Materials Science. 2000; 30(1): 263—298. https://doi.org/10.1146/annurev.matsci.30.1.263; Nuraje N., Su K. Perovskite ferroelectric nanomaterials. Nanoscale. 2013; 5(19): 8752—8780. https://doi.org/10.1039/C3NR02543H; Liu H., Yang X. A brief review on perovskite multiferroics. Ferroelectrics. 2017; 507(1): 69—85. https://doi.org/10.1080/00150193.2017.1283171; Gao W., Zhu Y., Wang Y., Yuan G., Liu J.-M. A review of flexible perovskite oxide ferroelectric films and their application. Journal of Materiomics. 2020; 6(1): 1—16. https://doi.org/10.1016/j.jmat.2019.11.001; Schroeder U., Park M.H., Mikolajick T., Hwang C.S. The fundamentals and applications of ferroelectric HfO2. Nature Reviews Materials. 2022; 7(8): 653—669. https://doi.org/10.1038/s41578-022-00431-2; Park M.H., Lee Y.H., Mikolajick T., Schroeder U., Hwang C.S. Review and perspective on ferroelectric HfO2-based thin films for memory applications. MRS Communications. 2018; 8(3): 795—808. https://doi.org/10.1557/mrc.2018.175; Mikolajick T., Müller S., Schenk T., Yurchuk E., Slesazeck S., Schröder U., Dünkel S., van Bentum R., Kolodinski S., Polakowski P., Müller J. Doped hafnium oxide — an enabler for ferroelectric field effect transistors. Advances in Science and Technology. 2014; 95: 136—145. https://doi.org/10.4028/www.scientific.net/ast.95.136; Giannozzi P., Baroni S., Bonini N., Calandra M., Car R., Cavazzoni C., Ceresoli D., Chiarotti G.L., Cococcioni M., Dabo I., Dal Corso A., Fabris S., Fratesi G., de Gironcoli S., Gebauer R., Gerstmann U., Gougoussis C., Kokalj A., Lazzeri M., Martin-Samos L., Marzari N., Mauri F., Mazzarello R., Paolini S., Pasquarello A., Paulatto L., Sbraccia C., Scandolo S., Sclauzero G., Seitsonen A.P., Smogunov A., Umari P., Wentzcovitch R.M. Quantum ESPRESSO: a modular and open-source software project for quantum simulations of materials. Journal of Physics: Condensed Matter. 2009; 21(39): 395502. https://doi.org/10.1088/0953-8984/21/39/395502; Dal Corso A. Pseudopotentials periodic table: From H to Pu. Computational Materials Science. 2014; 95: 337—350. https://doi.org/10.1016/j.commatsci.2014.07.043; Henkelman G., Uberuaga B.P., Jónsson H. A climbing image nudged elastic band method for finding saddle points and minimum energy paths. The Journal of Chemical Physics. 2000; 113(22): 9901—9904. https://doi.org/10.1063/1.1329672; Resta R. Polarization as a Berry Phase. Europhysics News. 1997; 28(1): 18—20. https://doi.org/10.1007/s00770-997-0018-4; https://met.misis.ru/jour/article/view/553

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