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Simple intrinsic defects in GaAs: numerical supplement

Technical Report ·
DOI:https://doi.org/10.2172/1039410· OSTI ID:1039410
 [1]
  1. Sandia National Laboratories (SNL-NM), Albuquerque, NM (United States)
This Report presents numerical tables summarizing properties of intrinsic defects in gallium arsenide, GaAs, as computed by density functional theory. This Report serves as a numerical supplement to the results published in: P.A. Schultz and O.A. von Lilienfeld, 'Simple intrinsic defects in GaAs', Modelling Simul. Mater. Sci Eng., Vol. 17, 084007 (2009), and intended for use as reference tables for a defect physics package in device models. The numerical results for density functional theory calculations of properties of simple intrinsic defects in gallium arsenide are presented.
Research Organization:
Sandia National Laboratories (SNL-NM), Albuquerque, NM (United States)
Sponsoring Organization:
USDOE
DOE Contract Number:
AC04-94AL85000
OSTI ID:
1039410
Report Number(s):
SAND--2012-2675
Country of Publication:
United States
Language:
English

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