[HTML][HTML] Bandgap engineering in III-nitrides with boron and group V elements: Toward applications in ultraviolet emitters

R Kudrawiec, D Hommel - Applied Physics Reviews, 2020 - pubs.aip.org
A key material system for opto-and high-power electronics are III-nitrides. Their functionality
can be expanded when bandgap engineering is extended beyond common materials such …

Exploring the electronic, mechanical, anisotropic and optical properties of the Sc-Al-C MAX phases from a first principles calculations

K Wang, X Zhang, F Wang - Chemical Physics Letters, 2024 - Elsevier
MAX phase series materials have the excellent thermal, electrical and mechanical
properties and have great research potential. To achieve a comprehensive understanding of …

Elastic anisotropy and thermal properties of MBN (M= Al, Ga) systems using first-principles calculations

C Yang, Y Duan, J Yu, M Peng, S Zheng, M Li - Vacuum, 2023 - Elsevier
In this paper, the elastic properties, Debye temperatures, thermal conductivities, and sound
velocities of MBN nitrides are explained systematically by considering the first-principles …

Fundamentals and emerging optical applications of hexagonal boron nitride: a tutorial

C Su, E Janzen, M He, C Li, A Zettl… - Advances in Optics …, 2024 - opg.optica.org
Hexagonal boron nitride (hBN), also known as white graphite, is a transparent layered
crystal with a wide bandgap. Its crystal structure resembles graphite, featuring layers …

Mechanical and thermal properties of in situ AlN/Al-12Si composite fabricated by laser powder bed fusion

XX **ong, ZX Liang, P Wang, Y Qi, ZW Chen… - Materials …, 2024 - Elsevier
This work reports on the synthesis, mechanical, and thermal properties of in situ AlN/Al-12Si
composite through laser powder bed fusion (LPBF) by blending Al-12Si powder with 5 vol …

[HTML][HTML] Thermodynamic properties for metal oxides from first-principles

J Brorsson, I Staničić, J Gastaldi, T Mattison… - Computational Materials …, 2024 - Elsevier
In this study, an efficient first-principles approach for calculating the thermodynamic
properties of mixed metal oxides at high temperatures is demonstrated. More precisely, this …

Effect of aluminum addition on the structure and electronic properties of boron nitride

J Zagorac, D Zagorac, B Babić, T Prikhna… - Journal of Solid State …, 2022 - Elsevier
The influence of the structure type on the boron nitride (BN) properties such as excellent
thermal and chemical stability and super hardness is well known. The effect of aluminum …

Facile preparation of BN coatings on graphite substrates and their binding strength

H Li, X Liu, T Jiang, T Li, J Wang, B Li, W Xue… - Ceramics …, 2023 - Elsevier
To decrease the curing temperature and achieve excellent binding strength of BN coatings
on graphite substrates, a proper Al (H 2 PO 4) 3 binder has been carefully designed where …

[HTML][HTML] Experimental determination of AlN in microalloyed steel and thermodynamic analysis

M Führer, S Zamberger, E Povoden-Karadeniz - Calphad, 2025 - Elsevier
Abstract Differential Scanning Calorimetry measurements are performed with a subsequent
postprocessing routine specially designed for dilute systems, aiming at the evaluation of the …

First-principles investigations on the elastic properties, thermodynamic properties, electronic structures and anisotropy sound velocity of AlTi3N, AlTi2N, AlTi4N3 and …

K Wang, X Zhang, F Wang - Chemical Physics Letters, 2025 - Elsevier
Al-Ti-N nitrides have drawn much more interest in recent years. The study used first-
principles calculations within density functional theory (DFT) to investigate the physical …