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Browsing Архитектурно-строительный факультет by Subject "ab-initio calculations"

Browsing Архитектурно-строительный факультет by Subject "ab-initio calculations"

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  • Usseinov, A.; Koishybayeva, Zh.; Platonenko, A.; Akilbekov, A.; Purans, J.; Pankratov, V.; Suchikova, Y.; Popov, A. I. (Latvian Journal of Physics and Technical Sciences, 2021)
    Gallium oxide β-Ga2 O3 is an important wide-band gap semiconductor. In this study, we have calculated the formation energy and transition levels of oxygen vacancies in β-Ga2 O3 crystal using the B3LYP hybrid ...

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