Mechanical properties of graphene and boronitrene

RC Andrew, RE Mapasha, AM Ukpong, N Chetty - Physical Review B …, 2012 - APS
We present an equation of state (EOS) that describes how the hydrostatic change in surface
area is related to two-dimensional in-plane pressure (F) and yields the measure of a …

X-ray diffraction of III-nitrides

MA Moram, ME Vickers - Reports on progress in physics, 2009 - iopscience.iop.org
The III-nitrides include the semiconductors AlN, GaN and InN, which have band gaps
spanning the entire UV and visible ranges. Thin films of III-nitrides are used to make UV …

Aluminium nitride cubic modifications synthesis methods and its features. Review

VS Kudyakova, RA Shishkin, AA Elagin… - Journal of the European …, 2017 - Elsevier
This article presents a brief review of the research progress achieved in the field of
aluminium nitride (AlN) metastable cubic modifications synthesis. It covers mainly the …

Gallium nitride nanostructures: Synthesis, characterization and applications

T Kente, SD Mhlanga - Journal of Crystal Growth, 2016 - Elsevier
GaN nanostructures have been extensively studied due to their important properties and
applications in many fields. The recent synthesis and uses of these nanostructures have …

Electronic structure and optical response of double perovskite Rb2NaCoF6 for optoelectronic devices

MU Din, J Munir, M Jamil, MA Saeed, Q Ain - Physica B: Condensed Matter, 2022 - Elsevier
The bonding nature, structural, electrical, and optical properties of Rb 2 NaCoF 6 has been
investigated using density functional theory (DFT) calculations in this communication. The …

Structural and elastic properties of cubic and hexagonal TiN and AlN from first-principles calculations

AJ Wang, SL Shang, Y Du, Y Kong, LJ Zhang… - Computational materials …, 2010 - Elsevier
The structural and elastic properties of TiN and AlN in both rock salt (cubic) and wurtzite
(hexagonal) structures have been studied by first-principles calculations within the …

Mechanical, thermodynamic and electronic properties of wurtzite and zinc-blende GaN crystals

H Qin, X Luan, C Feng, D Yang, G Zhang - Materials, 2017 - mdpi.com
For the limitation of experimental methods in crystal characterization, in this study, the
mechanical, thermodynamic and electronic properties of wurtzite and zinc-blende GaN …

Ab initio study of structural, electronic, elastic and high pressure properties of barium chalcogenides

A Bouhemadou, R Khenata, F Zegrar… - Computational Materials …, 2006 - Elsevier
A theoretical studies of structural, electronic, elastic and high pressure properties in barium
chalcogenides BaX (X= S, Se, Te, Po) are performed, using the full-potential augmented …

Highly enhanced piezoelectric property of co-doped AlN

Y Iwazaki, T Yokoyama, T Nishihara… - Applied Physics …, 2015 - iopscience.iop.org
We propose a series of new compositions of AlN-based piezoelectric material based on the
results of first-principles calculation. The composition is expressed by $(\alpha _ {y},\beta …

Hardness analysis of cubic metal mononitrides from first principles

BD Fulcher, XY Cui, B Delley, C Stampfl - Physical Review B—Condensed …, 2012 - APS
Density functional theory calculations are performed to evaluate the hardness of various
cubic metal nitrides: rocksalt TiN, VN, ZrN, NbN, AlN, and SiN; zincblende AlN and BN; and …