Influence of the exchange and correlation functional on the structure of amorphous InSb and In3SbTe2 compounds

We have investigated the structural, vibrational, and electronic properties of the amorphous phase of InSb and In3SbTe2 compounds of interest for applications in phase change non-volatile memories. Models of the amorphous phase have been generated by quenching from the melt by molecular dynamics sim...

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Veröffentlicht in:	The Journal of chemical physics 2016-05, Vol.144 (20), p.204508-204508
Hauptverfasser:	Gabardi, Silvia, Caravati, Sebastiano, Los, Jan H., Kühne, Thomas D., Bernasconi, Marco
Format:	Artikel
Sprache:	eng
Schlagworte:	Amorphous structure Chemical bonds Computer simulation Correlation Density functional theory Dependence Exchanging Indium antimonide Intermetallic compounds Molecular dynamics Phase change Phase transitions Physics Properties (attributes)
Online-Zugang:	Volltext
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