Browse
Submit Data
Databases
API
Help

Dataset Information

22 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

Two-dimensional vacancy platelets as precursors for basal dislocation loops in hexagonal zirconium.

ABSTRACT: Zirconium alloys are widely used structural materials of choice in the nuclear industry due to their exceptional radiation and corrosion resistance. However long-time exposure to irradiation eventually results in undesirable shape changes, irradiation growth, that limit the service life of the component. Crystal defects called loops, routinely seen no smaller than 13?nm in diameter, are the source of the problem. How they form remains a matter of debate. Here, using transmission electron microscopy, we reveal the existence of a novel defect, nanoscale triangle-shaped vacancy plates. Energy considerations suggest that the collapse of the atomically thick triangle-shaped vacancy platelets can directly produce dislocation loops. This mechanism agrees with experiment and implies a characteristic incubation period for the formation of dislocation loops in zirconium alloys.

SUBMITTER: Liu SM

PROVIDER: S-EPMC7666165 | biostudies-literature | 2020 Nov

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Publications

Two-dimensional vacancy platelets as precursors for basal dislocation loops in hexagonal zirconium.

Liu Si-Mian SM Beyerlein Irene J IJ Han Wei-Zhong WZ

Nature communications 20201113 1

Zirconium alloys are widely used structural materials of choice in the nuclear industry due to their exceptional radiation and corrosion resistance. However long-time exposure to irradiation eventually results in undesirable shape changes, irradiation growth, that limit the service life of the component. Crystal defects called <c> loops, routinely seen no smaller than 13 nm in diameter, are the source of the problem. How they form remains a matter of debate. Here, using transmission electron mic ...[more]

PMID: 33188199

Similar Datasets

Dislocation-controlled formation and kinetics of grain boundary loops in two-dimensional crystals.

Project description:The formation and kinetics of grain boundaries are closely related to the topological constraints imposed on their complex dislocation structure. Loop-shaped grain boundaries are unique structures to establish such a link because their overall topological "charge" is zero due to their null net Burgers vector. Here, we observe that a local rotational deformation of a 2D colloidal crystal with an optical vortex results in a grain boundary loop only if the product of its radius and misorientation exceeds a critical value. Above this value, the deformation is plastic and the grain boundary loop spontaneously shrinks at a rate that solely depends on this product, while otherwise, the deformation is elastically restored. We show that this elastic-to-plastic crossover is a direct consequence of the unique dislocation structure of grain boundary loops. At the critical value, the loop is structurally equivalent to the so-called "flower defect" and the shrinkage rate diverges. Our results thus reveal a general limit on the formation of grain boundary loops in 2D crystals and elucidate the central role of defects in both the onset of plasticity and the kinetics of grain boundaries.

| S-EPMC6142269 | biostudies-literature

Dislocation-enhanced experimental-scale vacancy loop formation in hcp Zirconium in one single collision cascade.

Project description:Large defects are the main factor leading to the degradation of material properties under irradiation environments. It is commonly assumed that the large defects are mainly formed through cluster growth under continuous irradiations. Besides this mechanism, recent experiments and simulations show that sometimes an individual ion can also directly create a large defect. Here we report a novel mechanism for the formation of the large defects, as discovered by our Molecular Dynamics (MD) simulations of the collision cascades in hcp Zirconium (Zr): a pre-existing edge dislocation (ED) can significantly promote the nucleation of the vacancy clusters, and even facilitate the direct formation of an experimental-scale large vacancy loop (about 3?nm) in only one single displacement cascade. This dislocation-related mechanism may be the key for understanding the experimental results in the low-dose irradiated Zr where the high-density large dislocation loops are observed but difficult to be explained by the two mechanisms mentioned above. Considering that intrinsic dislocations exist in nearly all crystalline materials, our results provide a significant concept: pre-existing dislocations have a strong influence on the primary damage production, and taking them into account is indispensable for assessing and improving the material's irradiation-resistance.

| S-EPMC4751535 | biostudies-literature

Two-Dimensional Hexagonal-Shaped Mesoporous Carbon Sheets for Supercapacitors.

Project description:Two-dimensional mesoporous hexagonal carbon sheets (MHCSs) have been prepared via a chemical vapor deposition method employing mesoporous Mg(OH)2 hexagonal sheets as the template and acetylene gas as the carbon precursor. MHCSs with porosity in the micropore-mesopore range have a high specific surface area of 1785 m2·g-1. The hierarchical microporous-mesoporous pore structure enables rapid ion transport across the hexagonal carbon sheets, resulting in superior electrochemical performance. The MHCS electrodes showed a maximum specific capacitance of 162 F·g-1 at 5 mV s-1 using the electrolyte 1-ethyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide (EMIM-TFSI). MHCS symmetric coin cells exhibited a maximum energy density of 67 Wh·kg-1 at 0.5 A·g-1 and a maximum power density of 14.97 kW·kg-1 at 10 A·g-1.

| S-EPMC9386700 | biostudies-literature

Two-dimensional crystals of carboxysome shell proteins recapitulate the hexagonal packing of three-dimensional crystals.

Project description:Bacterial microcompartments (BMCs) are large intracellular bodies that serve as simple organelles in many bacteria. They are proteinaceous structures composed of key enzymes encapsulated by a polyhedral protein shell. In previous studies, the organization of these large shells has been inferred from the conserved packing of the component shell proteins in two-dimensional (2D) layers within the context of three-dimensional (3D) crystals. Here, we show that well-ordered, 2D crystals of carboxysome shell proteins assemble spontaneously when His-tagged proteins bind to a monolayer of nickelated lipid molecules at an air-water interface. The molecular packing within the 2D crystals recapitulates the layered hexagonal sheets observed in 3D crystals. The results reinforce current models for the molecular design of BMC shells.

| S-EPMC2821281 | biostudies-literature

Rational Passivation of Sulfur Vacancy Defects in Two-Dimensional Transition Metal Dichalcogenides.

Project description:Structural defects vary the optoelectronic properties of monolayer transition metal dichalcogenides, leading to concerted efforts to control defect type and density via materials growth or postgrowth passivation. Here, we explore a simple chemical treatment that allows on-off switching of low-lying, defect-localized exciton states, leading to tunable emission properties. Using steady-state and ultrafast optical spectroscopy, supported by ab initio calculations, we show that passivation of sulfur vacancy defects, which act as exciton traps in monolayer MoS2 and WS2, allows for controllable and improved mobilities and an increase in photoluminescence up to 275-fold, more than twice the value achieved by other chemical treatments. Our findings suggest a route for simple and rational defect engineering strategies for tunable and switchable electronic and excitonic properties through passivation.

| S-EPMC8158852 | biostudies-literature

Shockwave generates < 100 > dislocation loops in bcc iron.

Project description:The formation mechanism of < 100 > interstitial dislocation loops in ferritic steels stemming from irradiation remains elusive, as their formations are either too short for experiments, or too long for molecular dynamics simulations. Here, we report on the formation of both interstitial and vacancy dislocation loops in high energy displacement cascades using large-scale molecular dynamics simulations with up to 220 million atoms. Riding the supersonic shockwave generated in the cascade, self-interstitial atoms are punched out to form < 100 > dislocation loops in only a few picoseconds during one single cascade event, which is several orders of magnitude faster than any existing mechanisms. The energy analysis suggests that the formation of the interstitial loops depends on kinetic energy redistribution, where higher incidence energy or larger atom mass could improve the probability of the direct nucleation of interstitial dislocation loops.

| S-EPMC6240105 | biostudies-literature

Nematic Liquid Crystal on a Two Dimensional Hexagonal Lattice and its Application.

Project description:We have studied the alignment of liquid crystal adsorbed onto graphene and hexagonal boron nitride by using a polarized optical microscope. From the experimental data, it was found that there were 6 different alignment orientations of the liquid crystal molecules on a single crystal substrate. This result has never been reported and is quite different from other previous results. As the hexagonal lattice has a threefold rotational symmetry, three different alignment orientations were expected, but our result seems counter-intuitive. We explain this result considering the bending of the tail of the liquid crystal molecules. Using this anchoring effect with six accurate discrete angles, a novel non-volatile display can be developed with micron-scale pixel size, due to the molecular level accuracy of the alignment.

| S-EPMC4542626 | biostudies-literature

Dislocation Multiplications in Extremely Small Hexagonal-structured Titanium Nanopillars Without Dislocation Starvation.

Project description:"Smaller is stronger" has been commonly observed in cubic structured and hexagonal close-packed (HCP) structured materials. Dislocation starvation phenomenon is highly responsible for the increase of strength at smaller scale in cubic materials. However, by using quantitative in situ transmission electron microscope (TEM) nano-mechanical testing on cylindrical titanium nano-pillars with diameters of ~150?nm but varied orientations and three dimensional dislocation tomography, we found that dislocation nucleation and multiplication dominate the plastic deformation of the nano-pillars with no sign of dislocation starvation, resulting in much better ability of dislocation storage and plastic stability of HCP structured materials at extremely small scale.

| S-EPMC5698332 | biostudies-other

Dislocation reactions, grain boundaries, and irreversibility in two-dimensional lattices using topological tweezers.

Project description:Dislocations, disclinations, and grain boundaries are topological excitations of crystals that play a key role in determining out-of-equilibrium material properties. In this article we study the kinetics, creation, and annihilation processes of these defects in a controllable way by applying "topological tweezers," an array of weak optical tweezers which strain the lattice by weakly pulling on a collection of particles without grabbing them individually. We use topological tweezers to deterministically control individual dislocations and grain boundaries, and reversibly create and destroy dislocation pairs in a 2D crystal of charged colloids. Starting from a perfect lattice, we exert a torque on a finite region and follow the complete step-by-step creation of a disoriented grain, from the creation of dislocation pairs through their reactions to form a grain boundary and their reduction of elastic energy. However, when the grain is rotated back to its original orientation the dislocation reactions do not retrace. Rather, the process is irreversible; the grain boundary expands instead of collapsing.

| S-EPMC3785718 | biostudies-literature

Dislocation-driven growth of two-dimensional lateral quantum-well superlattices.

Project description:The advent of two-dimensional (2D) materials has led to extensive studies of heterostructures for novel applications. 2D lateral multiheterojunctions and superlattices have been recently demonstrated, but the available growth methods can only produce features with widths in the micrometer or, at best, 100-nm scale and usually result in rough and defective interfaces with extensive chemical intermixing. Widths smaller than 5 nm, which are needed for quantum confinement effects and quantum-well applications, have not been achieved. We demonstrate the growth of sub-2-nm quantum-well arrays in semiconductor monolayers, driven by the climb of misfit dislocations in a lattice-mismatched sulfide/selenide heterointerface. Density functional theory calculations provide an atom-by-atom description of the growth mechanism. The calculated energy bands reveal type II alignment suitable for quantum wells, suggesting that the structure could, in principle, be turned into a "conduit" of conductive nanoribbons for interconnects in future 2D integrated circuits via n-type modulation doping. This misfit dislocation-driven growth can be applied to different combinations of 2D monolayers with lattice mismatch, paving the way to a wide range of 2D quantum-well superlattices with controllable band alignment and nanoscale width.

| S-EPMC5938231 | biostudies-other

OmicsDI is part of the ELIXIR infrastructure

OmicsDI is an Elixir interoperability service. Learn more ›

Tweets

OmicsDI Databases

PRIDE
PeptideAtlas
MassIVE
JPOST Repository
Physiome Model Repository

EGA
EVA
ENA
LINCS
PAXDB
Cell Collective

MetaboLights
Metabolomics Workbench
MetabolomeExpress
GNPS
BioModels
FAIRDOMHub

ArrayExpress
dbGaP
ExpressionAtlas
GEO
NODE

Information

Databases
Help
API
Contact us
Code on GitHub
Terms of use
Submit Data