Ferromagnetism in Gd doped ZnO nanowires: a first principles study
SA Aravindh, U Schwingenschloegl… - Journal of Applied …, 2014 - pubs.aip.org
In several experimental studies, room temperature ferromagnetism in Gd-doped ZnO
nanostructures has been achieved. However, the mechanism and the origin of the …
nanostructures has been achieved. However, the mechanism and the origin of the …
Interfacial structure and electronic properties of TiO2/ZnO/TiO2 for photocatalytic and photovoltaic applications: A theoretical study
S Haffad, KK Kiprono - Surface Science, 2019 - Elsevier
Understanding interface properties of heterojunction is an important step towards
controllable and tunable interfaces for photocatalytic and photovoltaic based devices. To this …
controllable and tunable interfaces for photocatalytic and photovoltaic based devices. To this …
Efficient nitrogen incorporation in ZnO nanowires
Abstract One-dimensional ZnO nanowires (NWs) are a promising materials system for a
variety of applications. Utilization of ZnO, however, requires a good understanding and …
variety of applications. Utilization of ZnO, however, requires a good understanding and …
Investigating the chemisorption of CO and CO2 on Al-and Cu-doped ZnO nanowires by density-functional calculations
M Maarouf, A Al-Sunaidi - Computational and Theoretical Chemistry, 2020 - Elsevier
The chemisorption of CO and CO 2 on zinc oxide triangular nanowires, doped with Al and
Cu atoms, was studied using density functional calculations. Adsorption energies for CO on …
Cu atoms, was studied using density functional calculations. Adsorption energies for CO on …
Ferromagnetism in Nd-doped ZnO nanowires and the influence of oxygen vacancies: ab initio calculations
Q Chen, J Wang - Physical Chemistry Chemical Physics, 2013 - pubs.rsc.org
Room-temperature ferromagnetism (RTFM) has been achieved in rare earth (RE) element
doped ZnO nanostructures, while the mechanism of RTFM is still under debate. In this work …
doped ZnO nanostructures, while the mechanism of RTFM is still under debate. In this work …
Effect of two identical 3d transition‐metal atoms M doping (M= V, Cr, Mn, Fe, Co, and Ni) on the structural, electronic, and magnetic properties of ZnO
H Liu, JM Zhang - physica status solidi (b), 2017 - Wiley Online Library
The effects of the kinds (M= V, Cr, Mn, Fe, Co, and Ni) and separation distances (d= 3.252,
4.600, 5.635, 6.504, 7.273, and 8.607 Å for (0, i= 1–6) configurations, respectively) of two …
4.600, 5.635, 6.504, 7.273, and 8.607 Å for (0, i= 1–6) configurations, respectively) of two …
Ferromagnetism induced by the charge transfer in Al-doped ZnO nanoparticles
The mechanism of ferromagnetism in Al-doped ZnO was investigated both theoretically and
experimentally. The density functional theory calculations were carried out to explore the …
experimentally. The density functional theory calculations were carried out to explore the …
Effects of N implantation on defect formation in ZnO nanowires
One-dimensional ZnO nanowires are a promising material system for a wide range of
optoelectronic and photonic applications. Utilization of ZnO, however, requires high-quality …
optoelectronic and photonic applications. Utilization of ZnO, however, requires high-quality …
Identification of a Nitrogen-related acceptor in ZnO nanowires
Nanostructured ZnO, such as ZnO nanowires (NWs), is a promising material system for a
wide range of electronic applications ranging from light emission to water splitting. Utilization …
wide range of electronic applications ranging from light emission to water splitting. Utilization …
Mechanism of the double heterostructure TiO2/ZnO/TiO2 for photocatalytic and photovoltaic applications: A theoretical study
S Haffad - arXiv preprint arXiv:1702.02545, 2017 - arxiv.org
Understanding the mechanism of the heterojunction is an important step towards
controllable and tunable interfaces for photocatalytic and photovoltaic based devices. To this …
controllable and tunable interfaces for photocatalytic and photovoltaic based devices. To this …