First-Principles Study of Vacancies in Ti3SiC2 and Ti3AlC2

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First-Principles Study of Vacancies in Ti3SiC2 and Ti3AlC2

MAX phase materials have attracted increased attention due to their unique combination of ceramic and metallic properties. In this study, the properties of vacancies in Ti3AlC2 and Ti3SiC2, which are two of the most widely studied MAX phases, were investigated using first-principles calculations. Our calculations indicate that the stabilities of vacancies in Ti3SiC2 and Ti3AlC2 differ greatly f...

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ژورنال

عنوان ژورنال: Materials

سال: 2017

ISSN: 1996-1944

DOI: 10.3390/ma10020103