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Coexistence of tetrahedral- and octahedral-like sites in amorphous phase change materials

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Caravati, S., Bernasconi, M., Kühne, T. D., Krack, M., Parrinello, M.·2007·Applied Physics Letters

Abstract

Chalcogenide alloys are materials of interest for optical recording and nonvolatile memories. We perform ab initio molecular dynamics simulations aiming at shading light onto the structure of amorphous Ge2Sb2Te5 (GST), the prototypical material in this class. First principles simulations show that amorphous GST obtained by quenching from the liquid phase displays two types of short range order. One third of Ge atoms are in a tetrahedral environment while the remaining Ge, Sb, and Te atoms display a defective octahedral environment, reminiscent of cubic crystalline GST.

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Metadata

Authors
Caravati, S., Bernasconi, M., Kühne, T. D., Krack, M., & Parrinello, M.
Venue
Applied Physics Letters
Published
2007-10-22
Volume
91
Issue
17
ISSN
  • 0003-6951 (ISSN-L)
  • 1077-3118
OpenAlex
W2002761831
Cited by
408
References
0
FWCI
8.78
Type
journal article
Language
en
Open access
green

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CoChat. (2026). Citation check: Coexistence of tetrahedral- and octahedral-like sites in amorphous phase change materials. https://app.cochat.ai/papers/10.1063/1.2801626
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Caravati, S., Bernasconi, M., Kühne, T. D., Krack, M., & Parrinello, M. (2007). Coexistence of tetrahedral- and octahedral-like sites in amorphous phase change materials. Applied Physics Letters. https://doi.org/10.1063/1.2801626

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Semantic Scholar’s data is described in: Kinney, R., et al. (2023). The Semantic Scholar Open Data Platform. arXiv:2301.10140.