The pressure-induced mechanical and optoelectronic behavior of cubic perovskite PbSnO3 via ab-initio investigations

NA Noor, Q Mahmood, M Rashid, BU Haq, A Laref - Ceramics International, 2018 - Elsevier
The density functional theory based full-potential linear-augmented-plane-wave plus local-
orbital method has been used to study the physical properties of PbSnO 3 in hypothetical …

A novel hollow flower-like 0D/3D Zn0. 5Cd0. 5S/NiCoZn-LDH photocatalyst with nn heterojunction for high hydrogen production

Y Sun, X Wang, Q Fu, C Pan - Applied Surface Science, 2021 - Elsevier
Photocatalytic decomposition of water for hydrogen production is considered a promising
solution to address the issues of energy crisis and environmental pollution. Herein, a kind of …

High-performance and scalable metal-chalcogenide semiconductors and devices via chalco-gel routes

SM Kwon, JK Won, JW Jo, J Kim, HJ Kim, HI Kwon… - Science …, 2018 - science.org
We report a general strategy for obtaining high-quality, large-area metal-chalcogenide
semiconductor films from precursors combining chelated metal salts with chalcoureas or …

[图书][B] Quaternary alloys based on II-VI semiconductors

V Tomashyk - 2014 - books.google.com
Doped by isovalent or heterovalent foreign impurities, II-VI semiconductor compounds
enable control of optical and electronic properties, making them ideal in detectors, solar …

Hybrid Functionals Study of Band Bowing, Band Edges and Electronic Structures of Cd1–xZnxS Solid Solution

JC Wu, J Zheng, CL Zacherl, P Wu… - The Journal of Physical …, 2011 - ACS Publications
We have systematically studied band bowing, band edges, and electronic properties of both
zinc-blende and wurtzite Cd1–x Zn x S solid solutions by using a special quasirandom …

Investigation of optical and thermoelectric properties of PbTiO3 under pressure

M Yaseen, H Ambreen, R Mehmood, M Iqbal… - Physica B: Condensed …, 2021 - Elsevier
The electronic, thermoelectric and optical properties of cubic PbTiO 3 perovskite's oxides
have been investigated under the variation of pressures within the frame work of DFT by …

Template-Free Synthesis of Zn1–xCdxS Nanocrystals with Tunable Band Structure for Efficient Water Splitting and Reduction of Nitroaromatics in Water

M Kaur, CM Nagaraja - ACS Sustainable Chemistry & …, 2017 - ACS Publications
A facile, one-pot, solvothermal synthesis of nanocrystals (NCs) of Zn1–x Cd x S (x= 0.1 (S1)–
0.9 (S9)) solid solutions has been successfully carried out using 4, 4′-dipyridyldisulfide …

Effects of Mg doping on physical properties of zinc-blende mercury selenide HgSe compound

Y Selmani, H Labrim, R El Bouayadi… - Physica B: Condensed …, 2022 - Elsevier
Structural, electronic and optical properties of Hg 1-x Mg x Se (x= 0, 0.25, 0.5, 0.75 and 1)
alloys have been investigated by using density functional theory calculations (DFT) with the …

Growth optimization of ZnxCd1-xS films on ITO and FTO coated glass for alternative buffer application in CdTe thin film solar cells

MS Hossain, KS Rahman, MA Islam, M Akhtaruzzaman… - Optical Materials, 2018 - Elsevier
In this study, Zn x Cd 1-x S/CdTe solar cells were fabricated on commercially available
indium tin oxide (In 2 O 3: Sn or ITO) and fluorine doped tin oxide (SnO 2: F or FTO) soda …

Unveiling concentration effects on the structural and optoelectronic characteristics of Zn 1− x Cd x S (x= 0, 0.25, 0.50, 0.75, 1) cubic semiconductors: a theoretical study

MA Iqbal, M Malik, A Zahid, MR Islam… - RSC …, 2022 - pubs.rsc.org
The structural and optoelectronic characteristics of Zn1− xCdxS (x= 0, 0.25, 0.50, 0.75, 1)
semiconductors are reported using density functional theory within GGA, EV-GGA, and mBJ …