| Literature DB >> 25044627 |
Volker L Deringer1, Wei Zhang, Marck Lumeij, Stefan Maintz, Matthias Wuttig, Riccardo Mazzarello, Richard Dronskowski.
Abstract
Despite its simple chemical constitution and unparalleled technological importance, the phase-change material germanium telluride (GeTe) still poses fundamental questions. In particular, the bonding mechanisms in amorphous GeTe have remained elusive to date, owing to the lack of suitable bond-analysis tools. Herein, we introduce a bonding indicator for amorphous structures, dubbed "bond-weighted distribution function" (BWDF), and we apply this method to amorphous GeTe. The results underline a peculiar role of homopolar Ge-Ge bonds, which locally stabilize tetrahedral fragments but not the global network. This atom-resolved (i.e., chemical) perspective has implications for the stability of amorphous "zero bits" and thus for the technologically relevant resistance-drift phenomenon.Entities:
Keywords: bond theory; crystal orbital overlap populations; molecular dynamics; phase-change materials; resistance drift
Year: 2014 PMID: 25044627 DOI: 10.1002/anie.201404223
Source DB: PubMed Journal: Angew Chem Int Ed Engl ISSN: 1433-7851 Impact factor: 15.336