Approximation to density functional theory for the calculation of band gaps of semiconductors

LG Ferreira, M Marques, LK Teles - Physical Review B—Condensed Matter …, 2008 - APS
The local-density approximation (LDA) together with the half occupation (transition state) is
notoriously successful in the calculation of atomic ionization potentials. When it comes to …

Quasiparticle band structure based on a generalized Kohn-Sham scheme

F Fuchs, J Furthmüller, F Bechstedt, M Shishkin… - Physical Review B …, 2007 - APS
We present a comparative full-potential study of generalized Kohn-Sham (gKS) schemes
with explicit focus on their suitability as starting point for the solution of the quasiparticle …

Origin of the bipolar doping behavior of SnO from X-ray spectroscopy and density functional theory

NF Quackenbush, JP Allen, DO Scanlon… - Chemistry of …, 2013 - ACS Publications
The origin of the almost unique combination of optical transparency and the ability to bipolar
dope tin monoxide is explained using a combination of soft and hard X-ray photoemission …

Atomic-orbital-based approximate self-interaction correction scheme for molecules and solids

CD Pemmaraju, T Archer, D Sánchez-Portal… - Physical Review B …, 2007 - APS
We present an atomic-orbital-based approximate scheme for self-interaction correction (SIC)
to the local-density approximation (LDA) of density-functional theory. The method, based on …

Ab‐initio theory of semiconductor band structures: New developments and progress

F Bechstedt, F Fuchs, G Kresse - physica status solidi (b), 2009 - Wiley Online Library
We present most recent developments to calculate the electronic states of semiconductors
and insulators without taking into account experimental parameters. They are based on the …

Large Area Ultrathin InN and Tin Doped InN Nanosheets Featuring 2D Electron Gases

N Syed, A Stacey, A Zavabeti, CK Nguyen, B Haas… - ACS …, 2022 - ACS Publications
Indium nitride (InN) has been of significant interest for creating and studying two-
dimensional electron gases (2DEG). Herein we demonstrate the formation of 2DEGs in …

Effect of dislocations on electrical and electron transport properties of InN thin films. II. Density and mobility of the carriers

V Lebedev, V Cimalla, T Baumann… - Journal of applied …, 2006 - pubs.aip.org
The influence of dislocations on electron transport properties of undoped InN thin films
grown by molecular-beam epitaxy on AlN (0001) pseudosubstrates is reported. The …

In adlayers on -plane InN surfaces: A polarity-dependent study by x-ray photoemission spectroscopy

TD Veal, PDC King, PH Jefferson, LFJ Piper… - Physical Review B …, 2007 - APS
The surfaces of In-and N-polarity InN grown by molecular-beam epitaxy have been
investigated using core-level and valence band x-ray photoemission spectroscopy (XPS) …

[HTML][HTML] Determination of the surface band bending in InxGa1− xN films by hard x-ray photoemission spectroscopy

M Lozac'h, S Ueda, S Liu, H Yoshikawa… - … and Technology of …, 2013 - Taylor & Francis
Core-level and valence band spectra of In x Ga 1− x N films were measured using hard x-ray
photoemission spectroscopy (HX-PES). Fine structure, caused by the coupling of the …

Surface evolution of thick InGaN epilayers with growth interruption time

Z Lv, H Wang, H Jiang - The Journal of Physical Chemistry C, 2021 - ACS Publications
Surface morphology of thick In x Ga1–x N (x∼ 0.14) epilayers mediated by growth
interruption was investigated. The interruption was performed by changing the turn-off time …