Search results for "crystalline materials"
showing 10 items of 42 documents
A Columnar Liquid Crystal with Permanent Polar Order
2015
et al.
Modelling intergranular and transgranular micro-cracking in polycrystalline materials
2018
Abstract In this work, a grain boundary formulation for intergranular and transgranular micro-cracking in three-dimensional polycrystalline aggregates is presented. The formulation is based on the displacement and stress boundary integral equations of solid mechanics and it has the advantage of expressing the polycrystalline problem in terms of grain boundary variables only. The individual grains within the polycrystalline morphology are modelled as generally anisotropic linear elastic domains with random spatial orientation. Transgranular micro-cracking is assumed to occur along specific cleavage planes, whose orientation in space within the grains depend upon the crystallographic lattice.…
Imidazolium-based liquid crystals: a modular platform for versatile new materials with finely tuneable properties and behaviour
2011
Ionic liquid Crystals constitute highly versatile materials that have drawn much interest these past few years in the fields of academic research and industrial development. In this respect, the present article is intended as an update of K. Binnemans review published in 2005, but focusing exclusively on the imidazolium cation - the most widely studied. Herein, imidazolium-containing thermotropic liquid crystalline materials will be sorted by molecular structure (mono-, bis-, poly-imidazolium compounds, with symmetrical and non-symmetrical structures) and discussed. Their physico-chemical properties will be exposed in order to adduce the relevancy and potential of the imidazolium platform i…
Boundary Element Crystal Plasticity Method
2017
A three-dimensional (3D) boundary element method for small strains crystal plasticity is described. The method, developed for polycrystalline aggregates, makes use of a set of boundary integral equations for modeling the individual grains, which are represented as anisotropic elasto-plastic domains. Crystal plasticity is modeled using an initial strains boundary integral approach. The integration of strongly singular volume integrals in the anisotropic elasto-plastic grain-boundary equations are discussed. Voronoi-tessellation micro-morphologies are discretized using nonstructured boundary and volume meshes. A grain-boundary incremental/iterative algorithm, with rate-dependent flow and har…
An integral framework for computational thermo-elastic homogenization of polycrystalline materials
2023
A grain scale framework for thermo-elastic analysis and computational homogenization of polycrystalline materials is proposed. The morphology of crystal aggregates is represented employing Voronoi tessellations, which retain the main statistical features of polycrystalline materials. The behaviour of the individual grains is modelled starting from an integral representation for anisotropic thermo-elasticity, which is numerically addressed through a dual reciprocity boundary element method. The integrity of the aggregate is enforced through suitable intergranular thermo-elastic continuity conditions. By virtue of the features of the underlying formulation, the polycrystalline thermo-elastic …
EXAFS and XANES analysis of oxides at the nanoscale
2014
This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence.
Two Novel Polyoxometalate-Encapsulated Metal–Organic Nanotube Frameworks as Stable and Highly Efficient Electrocatalysts for Hydrogen Evolution React…
2018
Two novel polyoxometalate (POM)-encapsulated metal–organic nanotube (MONT) framework crystalline materials with unprecedented copper-mixed ligands, HUST-200 and HUST-201, have been successfully synthesized by an effective synthesis strategy. The encapsulation not only provides a shield to increase the chemical stability, but also does not affect its catalytic activity, and, therefore, the crystalline materials are very active for HER (H+ can diffuse easily through the pores of the MONTs). Remarkably, HUST-200 displays a low overpotential of 131 mV (catalytic current density is equal to 10 mA·cm–2). This work thus offers a new way for devising HER electrocatalysts with low cost using POM-enc…
Template electrosyntesis of CeO2 nanotubes
2007
Nanotube arrays of CeO2 were produced in a single step by potentiostatic electrochemical deposition from a non-aqueous electrolyte, using anodic alumina membrane templates. The CeO2 nanotubes showed a polycrystalline structure, and they were assembled in the membrane nanochannels. The nanotubes had somewhat uniform diameters, with an average external value of about 210 nm, and a maximum length of about 60 µm; the latter parameter was controlled by the electrodeposition time. Each single nanotube was found to consist of crystalline grains having a size of about 3 nm. Raman analysis shows that these CeO2 nanotubes are suitable for catalytic applications.
Confined crystallization of a HKUST-1 metal–organic framework within mesostructured silica with enhanced structural resistance towards water
2017
A HKUST-1 metal–organic framework was crystallized in the NH2-modified mesostructured silica FDU-12 in order to improve its structural stability upon water exposure. In-depth structural characterization studies of the designed composite confirmed successful formation of the MOF phase within the ordered spherical mesopores of the silica matrix. In spite of the confinement within the cavities, MOF exhibits full accessibility for the adsorbed gas molecules. In contrast to the bulk HKUST-1, which undergoes slow phase transition in a humid environment, the structural integrity of the HKUST-1 in the humid-protective matrix remains unchanged even after immersion and stirring in water at elevated t…
Radiation damage of heavy crystalline detector materials by 24GeV protons
2013
Abstract Samples of three heavy crystalline materials: PbWO4, Bi4Si3O12, and PbF2 were irradiated in a high-intensity 24 GeV proton beam at the CERN PS to fluencies of 3.8×1013 protons/cm2. The optical transmission radiation damage was measured and all crystals show a shift of the cutoff in the transmission spectrum that is not observed when the crystals are irradiated with γ radiation. This shift of the cutoff under proton irradiation seems to be a general property of the heavy crystalline materials. A mechanism for this proton-induced transmission damage is discussed.