Results 61 to 70 of about 82,292 (297)

Size and shape of oxygen vacancies and protons in acceptor-doped barium zirconate [PDF]

open access: yes, 2015
The defect induced chemical expansion in acceptor-doped barium zirconate is investigated using density-functional theory (DFT) calculations. The two defect species involved in the hydration reaction, the +2 charged oxygen vacancy and the proton ...
Benediktsson, Magnús Þór   +3 more
core   +2 more sources

Oxygen Vacancy Engineering and Its Impact on Resistive Switching of Oxide Thin Films for Memory and Neuromorphic Applications

open access: yesChips
Oxygen vacancy engineering in metal oxides is a propitious route to modulate their resistive switching properties for memory and neuromorphic applications.
Biswajit Jana, Ayan Roy Chaudhuri
doaj   +1 more source

First-principles study of the morphology and surface structure of LaCoO3 and La0.5Sr0.5Fe0.5Co0.5O3 perovskites as air electrodes for solid oxide fuel cells

open access: yesScience and Technology of Advanced Materials: Methods, 2021
The slow kinetics of the oxygen exchange reaction at the surface of air electrodes for solid oxide fuel cells must be improved to reduce their operating temperature.
Masanobu Nakayama   +6 more
doaj   +1 more source

Atomic and electronic structure of YFeO3 surface with oxygen vacancies

open access: yesSt. Petersburg Polytechnical University Journal: Physics and Mathematics, 2022
The atomic and electronic structure of YFeO3 surfaces at the formation of oxygen vacancies are investigated by the methods of quantum-mechanical calculations. The (100), (001), and (010) surfaces are considered.
Gnidenko Anton, Chigrin Pavel
doaj   +1 more source

Mechanochemical Synthesis and Characterization of Nanostructured ErB4 and NdB4 Rare‐Earth Tetraborides

open access: yesAdvanced Engineering Materials, Volume 27, Issue 6, March 2025.
ErB4 and NdB4 nanostructured powders are produced by mechanochemical synthesis. 5 h mechanical alloying and 4 M HCl acid leaching are used in the production. ErB4 and NdB4 powders exhibit maximum magnetization of 0.4726 emu g−1 accompanied with an antiferromagnetic‐to‐paramagnetic phase transition at about TN = 18 K and 0.132 emu g−1 with a maximum at ...
Burçak Boztemur   +5 more
wiley   +1 more source

Adjustment of Coatings Morphology and Particle Distribution of Layered Silicates by Freeze‐Drying for Improved Gas Barriers

open access: yesAdvanced Engineering Materials, EarlyView.
Freeze‐drying of layered silicate is the key to get coatings with superior gas barrier. Freeze‐drying of layered silicates modified with dodecylamine (DDA) is a highly effective technique for the preparation of barrier pigments that significantly mitigate the permeation of oxygen, water vapor, and hydrogen through polymer films containing these ...
Joshua Lommes   +4 more
wiley   +1 more source

Oxygen-vacancy-ordering-induced metal-insulator transition in MgO single crystals

open access: yesResults in Physics, 2022
Dielectric properties of MgO single crystal were investigated in the temperature range of 300–1100 K and frequency range of 4x101-106 Hz. The sample exhibits intrinsic dielectric response below 400 K, two oxygen-vacancy-related phase transitions around ...
Chao Cheng   +6 more
doaj   +1 more source

Strain controlled oxygen vacancy formation and ordering in CaMnO$_3$

open access: yes, 2013
We use first-principles calculations to investigate the stability of bi-axially strained \textit{Pnma} perovskite CaMnO$_3$ towards the formation of oxygen vacancies.
Aschauer, Ulrich   +4 more
core   +1 more source

Molecular dynamics simulations of oxide memristors: crystal field effects [PDF]

open access: yes, 2011
We present molecular-dynamic simulations of memory resistors (memristors) including the crystal field effects on mobile ionic species such as oxygen vacancies appearing during operation of the device.
A. M. Bratkovsky   +4 more
core   +2 more sources

Trace Nickel Activated Biphasic Core‐CuOii/Shell‐CuOi Secondary Microspheres Enable Room Temperature Parts‐Per‐Trillion‐Level NO2 Detection

open access: yesAdvanced Engineering Materials, EarlyView.
An idea of designing novel sensors is proposed by creating appropriate Schottky barriers and vacancies between isomorphous Core‐CuOii/ Shell‐CuOi secondary microspheres and enhancing catalytic and spill‐over effects, and electronegativity via spontaneous biphasic separation, self‐assembly, and trace‐Ni‐doping.
Bala Ismail Adamu   +8 more
wiley   +1 more source

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