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At least 343 records · Page 19
All sourcesNASA NTRSDOE OSTI
DOE OSTI2018

Dynamic recrystallization kinetics and microstructure evolution of an AZ91D magnesium alloy during hot compression

Highlights: • DRX kinetic model is developed for the aged AZ91D magnesium alloy. • The DRX behavior in different strained regions was investigated. • Four morphologies of the second phase were proposed during the hot compression tests. • The nucleation mechanisms of the DRX grains were clarified. - Abstract: The flow behavior of as-cast AZ91D magnesium alloy was evaluated by isothermal compression tests within the temperatures of 220 °C, 260 °C, 300 °C, 340 °C, and 380 °C, and the strain rates of 0.001, 0.01, 0.1, 1 and 10s{sup −1}. Based on the stress-strain curve and hyperbolic sine function, the thermal activation energy and the strain rate sensitivity of the material were determined to be 142.2726 kJ·mol{sup −1} and 0.142, respectively. The S type evolution of the dynamic recrystallization with the increasing strain that dynamic recrystallization (DRX) model obtained from stress and strain data. There was a good consistency between the proposed DRX kinetics model and microstructure observation results. Combining isothermal compression specimens with finite element and scanning electron microscopy (SEM) analysis indicated that the sample can be divided into rarely recrystallized region, partially recrystallized region and completely recrystallized region, which falls within the dense deformation zone, free deformation zone and severe deformation zone, respectively. The different forms of the β-Mg{sub 17}Al{sub 12} phase induced by compression tests were confirmed by SEM. Nucleation mechanisms of the DRX were discussed with reference to the transmission electron microscope (TEM) analysis results.

36 MATERIALS SCIENCE↗
DOE OSTI2010

Electrical transport behavior of nonstoichiometric magnesium-zinc ferrite

This paper presents the direct current conductivity, alternate current conductivity and dielectric properties of nonstoichiometric magnesium-zinc ferrite below room temperature. The frequency exponent (s) of conductivity shows an anomalous temperature dependency. The magnitude of the temperature exponent (n) of dielectric permittivity strongly depends on frequency and its value decreases with increasing frequency. The grain boundary contribution is dominating over the grain contribution in conduction process and the temperature dependence of resistance due to grain and grain boundary contribution exhibits two activation regions. The ferrite shows positive alternating current magnetoconductivity. The solid state processing technique was used for the preparation of nanocrystalline ferrite powder from oxides of magnesium, zinc and iron. The X-ray diffraction methods were used in determining the structure and composition of obtained ferrite, while multimeter, impedance analyzer, liquid nitrogen cryostat and electromagnet were used in the study of conducting and dielectric properties of ferrite.

36 MATERIALS SCIENCE↗
DOE OSTI2013

Structure-dielectric properties relationships in copper-substituted magnesium ferrites

Graphical abstract: - Highlights: • Synthesis of copper substituted magnesium ferrites materials is reported. • A shift from cubic to tetragonal structure starting with x = 0.84 was observed. • The dielectric properties are influenced by Cu-substitution. - Abstract: Nanocrystalline powders of copper-substituted magnesium ferrites with general formula Mg{sub 1−x}Cu{sub x}Fe{sub 2}O{sub 4} (x = 0.00, 0.17, 0.34, 0.50, 0.67, 0.84, 1.00) were prepared for the first time by sol–gel auto-combustion method, using glycine as fuel agent. Solid phase chemical reactions and the occurrence of spinel structure were monitored by using infrared spectroscopy. X-ray diffraction analysis confirmed the spinel single-phase formation. A shift from cubic structure to tetragonal structure starting with x = 0.84 was also observed. Microstructure of the samples was analyzed by scanning electron microscopy and particle size was estimated from the micrographs. Analysis of dielectric properties revealed very low values of dielectric loss at frequencies over 10 MHz.

36 MATERIALS SCIENCE↗
DOE OSTI2021

Impact-induced twinning in a magnesium alloy under different stress conditions

We investigate deformation twinning in a highly textured magnesium alloy plate of Mg-3.1%Al-0.9%Zn-0.4%Mn under edge-on impact with in situ, synchrotron-based, ultrafast X-ray diffraction measurements, and corresponding stress states are simulated with the finite element method. Deformation twinning and its anisotropy under the triaxial stress condition are explained by a statistical analysis of resolved shear stress. The critical resolved shear stress criterion is applicable under complicated stress conditions induced by high strain rate impact loading. Three typical simple stress conditions are further explored as verification and application cases: uniaxial-stress, uniaxial-strain, and plane-stress. Extension twinning in the magnesium alloy is prone to occur for impact loading applied perpendicular to the crystallographic c-axis, regardless of the exact stress conditions.

36 MATERIALS SCIENCE↗
DOE OSTI2013

Femtosecond two-photon photoassociation of hot magnesium atoms: A quantum dynamical study using thermal random phase wavefunctions

Two-photon photoassociation of hot magnesium atoms by femtosecond laser pulses, creating electronically excited magnesium dimer molecules, is studied from first principles, combining ab initio quantum chemistry and molecular quantum dynamics. This theoretical framework allows for rationalizing the generation of molecular rovibrational coherence from thermally hot atoms [L. Rybak, S. Amaran, L. Levin, M. Tomza, R. Moszynski, R. Kosloff, C. P. Koch, and Z. Amitay, Phys. Rev. Lett. 107, 273001 (2011)]. Random phase thermal wavefunctions are employed to model the thermal ensemble of hot colliding atoms. Comparing two different choices of basis functions, random phase wavefunctions built from eigenstates are found to have the fastest convergence for the photoassociation yield. The interaction of the colliding atoms with a femtosecond laser pulse is modeled non-perturbatively to account for strong-field effects.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2013

Manufacture of gradient micro-structures of magnesium alloys using two stage extrusion dies

This paper aims to manufacture magnesium alloy metals with gradient micro-structures using hot extrusion process. The extrusion die was designed to have a straight channel part combined with a conical part. Materials pushed through this specially-designed die generate a non-uniform velocity distribution at cross sections inside the die and result in different strain and strain rate distributions. Accordingly, a gradient microstructure product can be obtained. Using the finite element analysis, the forming temperature, effective strain, and effective strain rate distributions at the die exit were firstly discussed for various inclination angles in the conical die. Then, hot extrusion experiments with a two stage die were conducted to obtain magnesium alloy products with gradient micro-structures. The effects of the inclination angle on the grain size distribution at cross sections of the products were also discussed. Using a die of an inclination angle of 15°, gradient micro-structures of the grain size decreasing gradually from 17 μm at the center to 4 μm at the edge of product were achieved.

36 MATERIALS SCIENCE↗
DOE OSTI2014

Microscopic properties of lithium, sodium, and magnesium battery anode materials related to possible dendrite growth

Lithium and magnesium exhibit rather different properties as battery anode materials with respect to the phenomenon of dendrite formation which can lead to short-circuits in batteries. Diffusion processes are the key to understanding structure forming processes on surfaces. Therefore, we have determined adsorption energies and barriers for the self-diffusion on Li and Mg using periodic density functional theory calculations and contrasted the results to Na which is also regarded as a promising electrode material in batteries. According to our calculations, magnesium exhibits a tendency towards the growth of smooth surfaces as it exhibits lower diffusion barriers than lithium and sodium, and as an hcp metal it favors higher-coordinated configurations in contrast to the bcc metals Li and Na. These characteristic differences are expected to contribute to the unequal tendencies of these metals with respect to dendrite growth.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2015

Effects of cation concentration on photocatalytic performance over magnesium vanadates

A series of magnesium vanadates (MgV {sub 2}O{sub 6}, Mg{sub 2}V {sub 2}O{sub 7}, and Mg{sub 3}V {sub 2}O{sub 8}) were synthesized to investigate the effect of cation concentration on photocatalytic performance. The samples were characterized by X-ray diffraction, field emission-scanning electron microscopy, UV-visible diffuse reflectance spectroscopy, and fluorescence spectroscopy. The photocatalytic O{sub 2} evolution experiments under visible light irradiation showed Mg{sub 2}V {sub 2}O{sub 7} exhibits the best performance, while Mg{sub 3}V {sub 2}O{sub 8} has the lowest activity. The density functional theory calculations indicated that the lowest unoccupied states of Mg{sub 3}V {sub 2}O{sub 8} are the mostly localized by the cation layers. The fluorescence spectra and fluorescence decay curves gave evident performances of excited states of magnesium vanadates and pointed out MgV {sub 2}O{sub 6} has a very short excited electron lift-time. Mg{sub 2}V {sub 2}O{sub 7} performs high photocatalytic activity because of its high electron mobility and long electron life-time.

36 MATERIALS SCIENCE↗
DOE OSTI2015

Spectroscopic studies of magnesium plasma produced by fundamental and second harmonics of Nd:YAG laser

In the present experimental work, laser induced magnesium plasma has been characterized using plasma parameters. The plasma has been generated by the fundamental (1064 nm) and second harmonics (532 nm) of Nd:YAG laser. The plasma parameters such as electron temperature and electron number density have been extracted using Boltzmann plot method and Stark broadened line profile, respectively. The laser irradiance dependence and spatial behavior of electron temperature and number density in laser induced magnesium plasma have been studied. The electron temperature as a function of laser irradiance (0.5 to 6.5 GW/cm{sup 2}) ranges from (9.16–10.37) × 10{sup 3 }K and (8.5–10.1)× 10{sup 3 }K, and electron number density from (0.99–1.08) × 10{sup 16} cm{sup −3} and (1.04–1.22) × 10{sup 16}cm{sup −3} for 1064 and 532 nm, respectively. These parameters exhibit fast increase at low laser irradiance and slow increase at high irradiance. The spatial distribution of electron temperature and electron number density shows same decreasing trend up to 2.25 mm from the target surface. The electron temperature and number density decrease from (9.5–8.6) × 10{sup 3 }K, (1.27–1.15) × 10{sup 16}cm{sup −3} and (10.56–8.85)× 10{sup 3 }K, (1.08–0.99) × 10{sup 16} cm{sup −3} for 532 nm and 1064 nm laser ablation wavelengths, respectively.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2015

Studies on structural properties of clay magnesium ferrite nano composite

Magnesium ferrite-bentonite clay composite was prepared by sol-gel combustion method employing citric acid as complexing agent and fuel. The effect of clay on the structural properties was studied with X-ray diffraction (XRD), Fourier transform infrared (FT-IR) Spectroscopy, Scanning electron microscopy (SEM), SEM- Energy dispersive Spectroscope (EDS) and BET surface area analyzer. Decrease in particle size and density was observed on addition of bentonite clay. The BET surface area of nano composite containing just 5 percent clay was 74.86 m{sup 2}/g. Whereas porosity increased from 40.5 per cent for the pure magnesium ferrite to 81.0 percent in the composite showing that nano-composite has potential application as an adsorbent.

36 MATERIALS SCIENCE↗
DOE OSTI2016

Synthesis and characterization of magnesium doped cerium oxide for the fuel cell application

Cerium oxide has attained much attentions in global nanotechnology market due to valuable application for catalytic, fuel additive, and widely as electrolyte in solid oxide fuel cell. Doped cerium oxide has large oxygen vacancies that allow for greater reactivity and faster ion transport. These properties make cerium oxide suitable material for SOFCs application. Cerium oxide electrolyte requires lower operation temperature which shows improvement in processing and the fabrication technique. In our work, we synthesized magnesium doped cerium oxide by the co-precipitation method. With the magnesium doping catalytic reactivity of CeO{sub 2} was increased. Synthesized nanoparticle were characterized by the XRD and UV absorption techniques.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2022

Structure of diopside, enstatite, and magnesium aluminosilicate glasses: A joint approach using neutron and x-ray diffraction and solid-state NMR

Neutron diffraction with magnesium isotope substitution, high energy x-ray diffraction, and 29 Si, 27 Al, and 25 Mg solid-state nuclear magnetic resonance (NMR) spectroscopy were used to measure the structure of glassy diopside (CaMgSi 2 O 6 ), enstatite (MgSiO 3 ), and four (MgO) x (Al 2 O 3 ) y (SiO 2 ) 1–x–y glasses, with x = 0.375 or 0.25 along the 50 mol. % silica tie-line (1 – x – y = 0.5) or with x = 0.3 or 0.2 along the 60 mol. % silica tie-line (1 – x – y = 0.6). The bound coherent neutron scattering length of the isotope 25 Mg was remeasured, and the value of 3.720(12) fm was obtained from a Rietveld refinement of the powder diffraction patterns measured for crystalline 25 MgO. The diffraction results for the glasses show a broad asymmetric distribution of Mg–O nearest-neighbors with a coordination number of 4.40(4) and 4.46(4) for the diopside and enstatite glasses, respectively. As magnesia is replaced by alumina along a tie-line with 50 or 60 mol. % silica, the Mg–O coordination number increases with the weighted bond distance as less Mg 2+ ions adopt a network-modifying role and more of these ions adopt a predominantly charge-compensating role. 25 Mg magic angle spinning (MAS) NMR results could not resolve the different coordination environments of Mg 2+ under the employed field strength (14.1 T) and spinning rate (20 kHz). The results emphasize the power of neutron diffraction with isotope substitution to provide unambiguous site-specific information on the coordination environment of magnesium in disordered materials.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2018

Laser frequency stabilisation on narrow resonances of cold magnesium atoms at the {sup 1}S{sub 0} – {sup 3}P{sub 1} transition

Experimental studies aimed at developing an optical frequency standard based on ultracold magnesium atoms with a relative uncertainty of Δν/ν < 10{sup –16} are performed. The frequency of the clock laser system at a wavelength of 457 nm is stabilised to narrow optical resonances (Ramsey fringes) in time-separated laser fields interacting with cold magnesium atoms localised in a magneto-optical trap (MOT). The frequency stability of the laser system is investigated using a femtosecond comb based on a Ti:sapphire laser. Long-term frequency stability (determined by the Allan function) of ∼5 × 10{sup –15} at averaging time τ = 1000 s is obtained. (paper)

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2022

Magnesium- and intermetallic alloys-based hydrides for energy storage: modelling, synthesis and properties

Hydrides based on magnesium and intermetallic compounds provide a viable solution to the challenge of energy storage from renewable sources, thanks to their ability to absorb and desorb hydrogen in a reversible way with a proper tuning of pressure and temperature conditions. Therefore, they are expected to play an important role in the clean energy transition and in the deployment of hydrogen as an efficient energy vector. This review, by experts of Task 40 ‘Energy Storage and Conversion based on Hydrogen’ of the Hydrogen Technology Collaboration Programme of the International Energy Agency, reports on the latest activities of the working group ‘Magnesium- and Intermetallic alloys-based Hydrides for Energy Storage’. The following topics are covered by the review: multiscale modelling of hydrides and hydrogen sorption mechanisms; synthesis and processing techniques; catalysts for hydrogen sorption in Mg; Mg-based nanostructures and new compounds; hydrides based on intermetallic TiFe alloys, high entropy alloys, Laves phases, and Pd-containing alloys. Finally, an outlook is presented on current worldwide investments and future research directions for hydrogen-based energy storage.

Energy storage↗
DOE OSTI2011

Configuration mixing of angular-momentum-projected triaxial relativistic mean-field wave functions. II. Microscopic analysis of low-lying states in magnesium isotopes

The recently developed structure model that uses the generator coordinate method to perform configuration mixing of angular-momentum projected wave functions, generated by constrained self-consistent relativistic mean-field calculations for triaxial shapes (3DAMP+GCM), is applied in a systematic study of ground states and low-energy collective states in the even-even magnesium isotopes {sup 20-40}Mg. Results obtained using a relativistic point-coupling nucleon-nucleon effective interaction in the particle-hole channel and a density-independent {delta} interaction in the pairing channel are compared to data and with previous axial 1DAMP+GCM calculations, both with a relativistic density functional and the nonrelativistic Gogny force. The effects of the inclusion of triaxial degrees of freedom on the low-energy spectra and E2 transitions of magnesium isotopes are examined.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2021

Cadmium Magnesium Telluride for Next Generation X-Ray Free Electron Laser, Synchrotron and Many Other Applications

We developed a picosecond photodetector based on our Bridgman grown and specially engineered Cadmium Magnesium Telluride (Cd 1-x Mg x Te) single crystal that is sensitive to both optical and x-ray pulses for coarse timing in Free Electron Laser applications. Cd 1-x Mg x Te is a wide bandgap semiconductor material with potential applications, not only in optoelectronics, but also in particle physics as an intense pulse radiation detector for bremsstrahlung, X-ray/gamma ray radiation, thermal neutrons, and medical imaging. However, for femtosecond optical and x-ray cross correlation, the material has to have very short lifetime, a condition that is opposite to that required for nuclear spectroscopy applications. At the same time, the material also needs to have very low bulk leakage current, in the 0.10 pA range. Hence the ability to tailor or engineer the material is very crucial. In this paper, picosecond response and the crystal growth of this specially engineered cadmium magnesium telluride material will be presented. Other material characterization and transient measurements will also be discussed along with room temperature semiconductor detector performance for other nuclear radiation detection applications.

36 MATERIALS SCIENCE↗
DOE OSTI2015

Strengthening and Improving Yield Asymmetry of Magnesium Alloys by Second Phase Particle Refinement Under the Guidance of Integrated Computational Materials Engineering

Improving yield strength and asymmetry is critical to expand applications of magnesium alloys in industry for higher fuel efficiency and lower CO 2 production. Grain refinement is an efficient method for strengthening low symmetry magnesium alloys, achievable by precipitate refinement. This study provides guidance on how precipitate engineering will improve mechanical properties through grain refinement. Precipitate refinement for improving yield strengths and asymmetry is simulated quantitatively by coupling a stochastic second phase grain refinement model and a modified polycrystalline crystal viscoplasticity φ-model. Using the stochastic second phase grain refinement model, grain size is quantitatively determined from the precipitate size and volume fraction. Yield strengths, yield asymmetry, and deformation behavior are calculated from the modified φ-model. If the precipitate shape and size remain constant, grain size decreases with increasing precipitate volume fraction. If the precipitate volume fraction is kept constant, grain size decreases with decreasing precipitate size during precipitate refinement. Yield strengths increase and asymmetry approves to one with decreasing grain size, contributed by increasing precipitate volume fraction or decreasing precipitate size.

36 MATERIALS SCIENCE↗
DOE OSTI2019

Hydrogen passivation of calcium and magnesium doped β-Ga 2 O 3

Calcium and magnesium doped beta-phase gallium oxide (β-Ga 2 O 3 ) single crystals were Czochralski grown in an iridium crucible and subsequently annealed in hydrogen at ~800° C. IR spectroscopy was used to investigate the roles of Mg and Ca dopants as well as H and Ir impurities. An IR peak at 3492 cm -1 was previously assigned to an O-H bond-stretching mode of a MgH complex in hydrogen-annealed Ga 2 O 3 :Mg and an IR peak at 3541 cm -1 is tentatively assigned to a similar mode in a CaH complex for H annealed Ga 2 O 3 :Ca. An IR peak at 5148 cm -1 is attributed to the presence of Ir 4+ when magnesium is present. Excitation with several different wavelengths used to confirm the position of the Ir level within the band gap. Our results suggest that isolated substitutional Ca dopants are less effective as deep acceptors than Mg. Polarization dependence of the iridium IR spectra is also discussed.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗