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Valence band splittings and band offsets of AlN, GaN, and InN

Journal Article · · Applied Physics Letters
DOI:https://doi.org/10.1063/1.117689· OSTI ID:388148
;  [1]
  1. National Renewable Energy Laboratory, Golden, Colorado 80401-3393 (United States)

First-principles electronic structure calculations on wurtzite AlN, GaN, and InN reveal crystal-field splitting parameters {Delta}{sub CF} of {minus}217, 42, and 41 meV, respectively, and spin{endash}orbit splitting parameters {Delta}{sub 0} of 19, 13, and 1 meV, respectively. In the zinc blende structure {Delta}{sub CF}{equivalent_to}0 and {Delta}{sub 0} are 19, 15, and 6 meV, respectively. The unstrained AlN/GaN, GaN/InN, and AlN/InN valence band offsets for the wurtzite (zinc blende) materials are 0.81 (0.84), 0.48 (0.26), and 1.25 (1.04) eV, respectively. The trends in these spectroscopic quantities are discussed and recent experimental findings are analyzed in light of these predictions. {copyright} {ital 1996 American Institute of Physics.}

Research Organization:
National Renewable Energy Laboratory
DOE Contract Number:
AC36-83CH10093
OSTI ID:
388148
Journal Information:
Applied Physics Letters, Journal Name: Applied Physics Letters Journal Issue: 18 Vol. 69; ISSN APPLAB; ISSN 0003-6951
Country of Publication:
United States
Language:
English

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