Search results for "Computer Science Application"
showing 10 items of 3998 documents
A three-dimensional cohesive-frictional grain-boundary micromechanical model for intergranular degradation and failure in polycrystalline materials
2013
Abstract In this study, a novel three-dimensional micro-mechanical crystal-level model for the analysis of intergranular degradation and failure in polycrystalline materials is presented. The polycrystalline microstructures are generated as Voronoi tessellations, that are able to retain the main statistical features of polycrystalline aggregates. The formulation is based on a grain-boundary integral representation of the elastic problem for the aggregate crystals, that are modeled as three-dimensional anisotropic elastic domains with random orientation in the three-dimensional space. The boundary integral representation involves only intergranular variables, namely interface displacement di…
A local chemical potential approach within the variable charge method formalism
2008
A new and computationally efficient implementation of the variable charge method of Streitz and Mintmire (1994 Phys. Rev. B 50 11996) is presented. In particular a local chemical potential approach that optimizes the charge on only those atoms expected to be ionic is developed. By doing so, the charge fluctuation problem experienced in regions far from any oxygen is solved, leading to a linear minimization problem of the electrostatic energy. In the dilute oxygen limit, such an approach can lead to at least an order of magnitude saving in computation.
Diagnostic Performance and Radiation Dose of the EOS System to Image Enchondromatosis: A Phantom Study
2020
Background: Radiation doses and capability of EOS, conventional radiography (CR), and computed tomography (CT) to detect and measure enchondromas in a dedicated five-year-old anthropomorphic phantom were compared. Methods: To simulate enchondromas, minced pieces of chicken bone and cartilage were packed in conventional kitchen plastic foil to create ovoidal/rounded masses and randomly hung on the phantom. The phantom was imaged five times with CR, CT, and EOS, each time changing the number and position of inserts. All images were reviewed by a senior radiologist and a radiology resident. Results: EOS and CR detected all inserts in 4/5 cases (80%), while in one case 1/17 inserts was not seen…
Modelling of Pe C alloys solidification using the artificial heat source method
1997
Abstract In the paper the numerical solutions concerning the cast iron and also the carbon steel solidification are presented. In order to take into account the non-linearities appearing in differential equations describing the boundary-initial problem considered — a certain algorithm called the artificial heat source method has been used. The examples illustrating the possibilities of proposed method applications have been solved by means of the boundary element method, but the others numerical methods can be also utilized.
Solid state bonding in extrusion and FSW: process mechanics and analogies
2006
Abstract The solid state bonding occurring in extrusion and in friction stir welding (FSW) processes is investigated through FEM models previously developed and validated. In particular, for the AA6082-T6 aluminum alloys, the most relevant field variables have been monitored and compared, such as strain, strain rate, effective stress and pressure. The aim of the research is the development of an effective FSW bonding criterion.
Performance Enhancement of Alkaline Water Electrolyzer Using Nanostructured Electrodes Synthetized by Template Electrosynthesis
2018
The increase of power generation by renewable sources is causing problems in the management of the electricity grid. In order to favor the transition from the current energy production towards renewable energy sources, it is necessary to plan strategy to develop suitable energy storage systems. Certainly, the electrochemical hydrogen production can be considered as one of the most promising storage technologies. In this work, an innovative alkaline electrolyzer is presented from its design based on the use of nanostructured electrodes up to its implementation suggested by the results of tests simulating real operation. The nanostructured electrodes were fabricated by template electrosynthes…
COOLING RATE DEPENDENCE AND DYNAMIC HETEROGENEITY BELOW THE GLASS TRANSITION IN A LENNARD–JONES GLASS
1999
We investigate a binary Lennard-Jones mixture with molecular dynamics simulations. We consider first a system cooled linearly in time with the cooling rate gamma. By varying gamma over almost four decades we study the influence of the cooling rate on the glass transition and on the resulting glass. We find for all investigated quantities a cooling rate dependence; with decreasing cooling rate the system falls out of equilibrium at decreasing temperatures, reaches lower enthalpies and obtains increasing local order. Next we study the dynamics of the melting process by investigating the most immobile and most mobile particles in the glass. We find that their spatial distribution is heterogene…
Electroplated bismuth absorbers for planar NTD-Ge sensor arrays applied to hard x-ray detection in astrophysics
2018
Single sensors or small arrays of manually assembled neutron transmutation doped germanium (NTD-Ge) based microcalorimeters have been widely used as high energy-resolution detectors from infrared to hard X-rays. Several planar technological processes were developed in the last years aimed at the fabrication of NTD-Ge arrays, specifically designed to produce soft X-ray detectors. One of these processes consists in the fabrication of the absorbers. In order to absorb efficiently hard X-ray photons, the absorber has to be properly designed and a suitable material has to be employed. Bismuth offers interesting properties in terms of absorbing capability, of low heat capacity (needed to obtain h…
Fabrication and Characterisation of Perovskite Thin Films for Photovoltaic Application
2018
This paper presents an alternative way to obtain perovskite thin films for photovoltaic application. This technique results more competitive, scalable, low-cost, reproducible and is different from other most common methods of fabrication.
Mathematical modelling of the industrial growth of large silicon crystals by CZ and FZ process
2003
The present paper gives an overview of the complex mathematical modelling of industrial Czochralski (CZ) and floating‐zone (FZ) processes for the growth of large silicon single crystals from melt. Extensive numerical investigations of turbulent Si‐melt flows in large diameter CZ crucibles, global thermal calculations in growth facilities and analysis of the influence of various electromagnetic fields on CZ process are presented. For FZ process, a complex system of coupled 2D and 3D mathematical models is presented to show the possibilities of modelling from the calculation of the molten zone shape till the resistivity distribution in the grown crystal. A special developed program code is pr…