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Assessing the accuracy of hybrid functionals in the determination of defect levels: Application to the As antisite in GaAs

✍ Scribed by Komsa, Hannu-Pekka; Pasquarello, Alfredo


Book ID
120552373
Publisher
The American Physical Society
Year
2011
Tongue
English
Weight
284 KB
Volume
84
Category
Article
ISSN
1098-0121

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Assessment of the Accuracy of the Determ
✍ H. L. Giles; P. W. Hurley πŸ“‚ Article πŸ“… 1997 πŸ› John Wiley and Sons 🌐 English βš– 532 KB

In an earlier study, the accuracy of the determination of below about 0.5% (m/m) in samples prepared as Na 2 O fused beads was found to be poor with an RMS of 0.14 and a k factor of 0.11. Three possible sources of this inaccuracy were studied, and an improvement to an RMS of about 0.025 and a k fact