The structural, mechanical, electronic, optical and thermodynamic properties of t-X₃As₄ (X = Si, Ge and Sn) by first-principles calculations

• Veröffentlicht in: Condensed Matter Physics
• Datum: 2018
• Hauptverfasser: Yang, R., Ma, Y., Wei, Q., Zhang, D., Zhou, Y.
• Format: Artikel
• Sprache: Englisch
• Veröffentlicht: Інститут фізики конденсованих систем НАН України 2018
• Online Zugang: https://nasplib.isofts.kiev.ua/handle/123456789/157453
• Назва журналу: Digital Library of Periodicals of National Academy of Sciences of Ukraine
• Zitieren: The structural, mechanical, electronic, optical and thermodynamic properties of t-X₃As₄ (X = Si, Ge and Sn) by first-principles calculations / R. Yang, Y. Ma, Q. Wei, D. Zhang, Y. Zhou // Condensed Matter Physics. — 2018. — Т. 21, № 4. — С. 43601: 1–14. — Бібліогр.: 20 назв. — англ.

The structural, mechanical, electronic, optical and thermodynamic properties of the t-X₃As₄ (X = Si, Ge and Sn)
 with tetragonal structure have been investigated by first principles calculations. Our calculated results show that
 these compounds are mechanically and dynamically stabl...