No Arabic abstract
The microstructural features and high-temperature oxidation resistance of hybrid (TiC+TiB) networks reinforced Ti-6Al-4V composites were investigated after fabricated with reaction hot pressing technique. The inhomogeneous distribution of hybrid reinforcers resulted in a sort of stress-induced grain refinement for {alpha}-Ti matrix phase, which was further facilitated by heterogeneous nucleation upon additive interfaces. HRTEM analyses revealed the crystallographic orientation relation between TiB and alpha-Ti phases as (201)TiB//(-1100)alpha-Ti plus [11-2]//[0001] alpha-Ti, while TiC and {alpha}-Ti phases maintained the interrelation of (-200)TiC//(-2110) {alpha}-Ti and [001]TiC//[01-10] alpha-Ti. The hybridly reinforced Ti-6Al-4V/(TiC+TiB) composites displayed superior oxidation resistance to both the sintered matrix alloy and the two composites reinforced solely with TiC or TiB addition during the cyclic oxidation at 873, 973 and 1073 K respectively for 100 h. The hybrid reinforcers volume fraction was a more influential factor to improve oxidation resistance than the matrix alloy powder size. As temperature rose from 873 to 1073 K, the oxidation kinetics transferred from the nearly parabolic type through qusilinear tendency into the finally linear mode. This corresponded to the morphological transition of oxide scales from a continuous protective film to a partially damaged layer and ended up with the complete spallation of alternating alumina and rutile multilayers. A phenomenological model was proposed to elucidate the growth process of oxides scales. The release of thermal stress, the suppression of oxygen diffusion and the fastening of oxide adherence were found as the three major mechanisms to enhance the oxidation resistance of hybrid reinforced composites.
Although of practical importance, there is no established modeling framework to accurately predict high-temperature cyclic oxidation kinetics of multi-component alloys due to the inherent complexity. We present a data analytics approach to predict the oxidation rate constant of NiCr-based alloys as a function of composition and temperature with a highly consistent and well-curated experimental dataset. Two characteristic oxidation models, i.e., a simple parabolic law and a statistical cyclic-oxidation model, have been chosen to numerically represent the high-temperature oxidation kinetics of commercial and model NiCr-based alloys. We have successfully trained machine learning (ML) models using highly ranked key input features identified by correlation analysis to accurately predict experimental parabolic rate constants (kp). This study demonstrates the potential of ML approaches to predict oxidation kinetics of alloys over a wide composition and temperature ranges. This approach can also serve as a basis for introducing more physically meaningful ML input features to predict the comprehensive cyclic oxidation behavior of multi-component high-temperature alloys with proper constraints based on the known underlying mechanisms.
The damage mechanisms and load redistribution of high strength TC17 titanium alloy/unidirectional SiC fibre composite (fibre diameter = 100 $mu$m) under high temperature (350 {deg}C) fatigue cycling have been investigated in situ using synchrotron X-ray computed tomography (CT) and X-ray diffraction (XRD) for high cycle fatigue (HCF) under different stress amplitudes. The three-dimensional morphology of the crack and fibre fractures has been mapped by CT. During stable growth, matrix cracking dominates with the crack deflecting (by 50-100 $mu$m in height) when bypassing bridging fibres. A small number of bridging fibres have fractured close to the matrix crack plane especially under relatively high stress amplitude cycling. Loading to the peak stress led to rapid crack growth accompanied by a burst of fibre fractures. Many of the fibre fractures occurred 50-300 $mu$m from the matrix crack plane during rapid growth, in contrast to that in the stable growth stage, leading to extensive fibre pull-out on the fracture surface. The changes in fibre loading, interfacial stress, and the extent of fibre-matrix debonding in the vicinity of the crack have been mapped for the fatigue cycle and after the rapid growth by high spatial resolution XRD. The fibre/matrix interfacial sliding extends up to 600 $mu$m (in the stable growth zone) or 700 $mu$m (in the rapid growth zone) either side of the crack plane. The direction of interfacial shear stress reverses with the loading cycle, with the maximum frictional sliding stress reaching ~55 MPa in both the stable growth and rapid growth regimes.
A thorough understanding of native oxides is essential for designing semiconductor devices. Here we report a study of the rate and mechanisms of spontaneous oxidation of bulk single crystals of ZrS$_x$Se$_{2-x}$ alloys and MoS$_2$. ZrS$_x$Se$_{2-x}$ alloys oxidize rapidly, and the oxidation rate increases with Se content. Oxidation of basal surfaces is initiated by favorable O$_2$ adsorption and proceeds by a mechanism of Zr-O bond switching, that collapses the van der Waals gaps, and is facilitated by progressive redox transitions of the chalcogen. The rate-limiting process is the formation and out-diffusion of SO$_2$. In contrast, MoS$_2$ basal surfaces are stable due to unfavorable oxygen adsorption. Our results provide insight and quantitative guidance for designing and processing semiconductor devices based on ZrS$_x$Se$_{2-x}$ and MoS$_2$, and identify the atomistic-scale mechanisms of bonding and phase transformations in layered materials with competing anions.
A high-intensity proton beam exposure with 181 MeV energy has been conducted at Brookhaven Linac Isotope Producer facility on various material specimens for accelerator targetry applications, including titanium alloys as a beam window material. The radiation damage level of the analyzed capsule was 0.25 dpa at beam center region with an irradiation temperature around 120 degree C. Tensile tests showed increased hardness and a large decrease in ductility for the dual alpha+beta-phase Ti-6Al-4V Grade-5 and Grade-23 extra low interstitial alloys, with the near alpha-phase Ti-3Al-2.5V Grade-9 alloy still exhibiting uniform elongation of a few % after irradiation. Transmission Electron Microscope analyses on Ti-6Al-4V indicated clear evidence of a high-density of defect clusters with size less than 2 nm in each alpha-phase grain. The beta-phase grains did not contain any visible defects such as loops or black dots, while the diffraction patterns clearly indicated omega-phase precipitation in an advanced formation stage. The radiation-induced omega-phase transformation in the beta-phase could lead to greater loss of ductility in Ti-6Al-4V alloys in comparison with Ti-3Al-2.5V alloy with less beta-phase.
We report a first-principles study of the energetics of hydrogen absorption and desorption (i.e. H-vacancy formation) on pure and Ti-doped sodium alanate (NaAlH4) surfaces. We find that the Ti atom facilitates the dissociation of H2 molecules as well as the adsorption of H atoms. In addition, the dopant makes it energetically more favorable to creat H vacancies by saturating Al dangling bonds. Interestingly, our results show that the Ti dopant brings close in energy all the steps presumably involved in the absorption and desorption of hydrogen, thus facilitating both and enhancing the reaction kinetics of the alanates. We also discuss the possibility of using other light transition metals (Sc, V, and Cr) as dopants.