Results 21 to 30 of about 1,320,249 (296)

Effect of reconstructed vacancy defects on the crumpling behavior of graphene sheets

open access: yesForces in Mechanics, 2022
Understanding the influence of reconstructed single vacancy (SV) defects on the crumpling behavior of graphene sheets is crucial for successful implementation of graphene in advanced technologies.
Yangchao Liao   +3 more
doaj   +1 more source

Effect of extended defects on photoluminescence of gallium oxide and aluminum gallium oxide epitaxial films

open access: yesScientific Reports, 2022
In this work, a systematic photoluminescence (PL) study on three series of gallium oxide/aluminum gallium oxide films and bulk single crystals is performed including comparing doping, epitaxial substrates, and aluminum concentration.
Jacqueline Cooke   +6 more
doaj   +1 more source

Advanced Mapping of Optically-Blind and Optically-Active Nitrogen Chemical Impurities in Natural Diamonds

open access: yesChemosensors, 2022
Natural diamonds with a rich variety of optically blind and optically active nitrogen impurity centers were explored at a nano/microscale on the surface and in bulk by a number of advanced chemical and structural analytical tools in order to achieve a ...
Sergey Kudryashov   +9 more
doaj   +1 more source

Surface Structure and Electronic Properties of Lu3Al5O12

open access: yesCrystals, 2021
Lu3Al5O12 (LuAG) is a famous scintillator that has the advantages of high efficiency, high light yield, and fast decay after being doped with active ions. F centers (oxygen vacancies with two electrons) and antisite defects are the most important defects
Weian Guo   +3 more
doaj   +1 more source

Resistivity of Surface Steps in Bulk-Insulating Topological Insulators

open access: yesFrontiers in Materials, 2022
Electron transport in topological insulators usually involves both topologically protected surface states and trivial electronic states in the bulk material.
Wonhee Ko   +7 more
doaj   +1 more source

Topological defects and SUSY RG flow

open access: yesJournal of High Energy Physics, 2021
We study the effect of bulk perturbations of N=(2) superconformal minimal models on topological defects. In particular, symmetries and more general topological defects which survive the flow to the IR are identified.
I. Brunner, I. Mayer, C. Schmidt-Colinet
doaj   +1 more source

Identification of bulk oxide defects in an electrochemical environment

open access: yesFaraday Discussions, 2015
We discuss how electronic-structure calculations can be used to identify the dominant point defects that control the growth and dissolution of the oxide barrier layer formed if a metal comes into contact with a corrosive environment.
Mira Todorova, Jörg Neugebauer
openaire   +4 more sources

Defect-Mediated Lithium Adsorption and Diffusion on Monolayer Molybdenum Disulfide [PDF]

open access: yes, 2015
Monolayer Molybdenum Disulfide (MoS2) is a promising anode material for lithium ion batteries because of its high capacities. In this work, first principle calculations based on spin density functional theory were performed to investigate adsorption and ...
Xiaoli Sun   +5 more
core   +1 more source

materialsproject/pymatgen-analysis-defects: v2022.10.4

open access: yes, 2022
What's Changed Defect transition CCD by @jmmshn in https://github.com/materialsproject/pymatgen-analysis-defects/pull/33 fix repository url by @njzjz in https://github.com/materialsproject/pymatgen-analysis-defects/pull/35 fixed test by @jmmshn in https:
nwinner   +3 more
core   +1 more source

Charged Point Defects in the Flatland: Accurate Formation Energy Calculations in Two-Dimensional Materials

open access: yesPhysical Review X, 2014
Impurities and defects frequently govern materials properties, with the most prominent example being the doping of bulk semiconductors where a minute amount of foreign atoms can be responsible for the operation of the electronic devices.
Hannu-Pekka Komsa   +3 more
doaj   +1 more source

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