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At least 577 records · Page 32

Extended chondrule formation intervals in distinct physicochemical environments: Evidence from Al-Mg isotope systematics of CR chondrite chondrules with unaltered plagioclase

Al-Mg isotope systematics of twelve FeO-poor (type I) chondrules from CR chondrites Queen Alexandra Range 99177 and Meteorite Hills 00426 were investigated by secondary ion mass spectrometry (SIMS). Five chondrules with Mg#’s of 99.0 to 99.2 and Δ 17 O of -4.2‰ to -5.3‰ have resolvable excess 26 Mg. Their inferred ( 26 Al/ 27 Al) 0 values range from (3.5 ± 1.3) × 10 -6 to (6.0 ± 3.9) × 10 -6 . This corresponds to formation times of 2.2 (–0.5/+1.1) Myr to 2.8 (-0.3/+0.5) Myr after CAIs, using a canonical ( 26 Al/ 27 Al) 0 of 5.23 × 10 -5 , and assuming homogeneously distributed 26Al that yielded a uniform initial 26 Al/ 27 Al in the Solar System. Seven chondrules lack resolvable excess 26 Mg. They have lower Mg#’s (94.2 to 98.7) and generally higher Δ 17 O (-0.9‰ to -4.9‰) than chondrules with resolvable excess 26 Mg. Their inferred ( 26 Al/ 27 Al) 0 upper limits range from 1.3 × 10 -6 to 3.2 × 10 -6 , corresponding to formation >2.9 to >3.7 Myr after CAIs. Al-Mg isochrons depend critically on chondrule plagioclase, and several characteristics indicate the chondrule plagioclase is unaltered: (1) SIMS 27 Al/ 24 Mg depth profile patterns match those from anorthite standards, and SEM/EDS of chondrule SIMS pits show no foreign inclusions; (2) transmission electron microscopy (TEM) reveals no nanometer-scale micro-inclusions and no alteration due to thermal metamorphism; (3) oxygen isotopes of chondrule plagioclase match those of coexisting olivine and pyroxene, indicating a low extent of thermal metamorphism; and (4) electron microprobe data show chondrule plagioclase is anorthite-rich, with excess structural silica and high MgO, consistent with such plagioclase from other petrologic type 3.00-3.05 chondrites. We conclude that the resolvable ( 26 Al/ 27 Al) 0 variabilities among chondrules studied are robust, corresponding to a formation interval of at least 1.1 Myr.

79 ASTRONOMY AND ASTROPHYSICS↗

Effects of crystallographic orientation on calcite dissolution under alkaline conditions

Here, this study investigates the dissolution of calcite’s (104) and (100) surfaces under alkaline conditions (pH 8.8–13.1) using vertical scanning interferometry under flow-through conditions. The dissolution rate of (100) surfaces decreases with increasing pH. For example, the dissolution rate at pH 8.8 is more than 20 times higher than that at pH 13.1. In contrast, the dissolution rate of (104) surfaces is far less sensitive to pH. We explain these observations as being on account of the preferential adsorption of [OH – ] on (100) surfaces, inhibiting their dissolution. Particularly, this is because Ca-surface sites on (100) surfaces are less coordinated and have a stronger tendency for [OH – ] adsorption. As a result, (100) surfaces dissolve nearly twice as fast as (104) surfaces at pH 8.8, whereas (104) surfaces dissolved ~4.5 times faster than (100) surfaces at pH 13.1; indicating an inversion in dissolution behavior. The dissolution rate of (104) surfaces at pH 13.1 is 60 % of the rate at pH 10–12 because of the formation of slow dissolving microfacets of other orientations. The rhombohedral dissolution etch-pits formed on (104) surfaces, at lower pH’s, disappeared upon exposure to solutions with pH > 12 and were replaced by protrusions. The addition of up to 4m (molality) NaCl enhances the dissolution of (104) surfaces at pH 8.8–13.1 and (100) surfaces at pH 8.8–11.0, and inhibited the dissolution of (100) surfaces at pH = 12.0–13.1. In addition, the competing adsorption between OH – and CO 3 2– species mitigates the inhibition effects of CO 3 2– on both surfaces at pH 13.1 compared to pH 11, and the dissolution of (100) surfaces is far less affected by CO 3 2– than (104) surfaces. These results provide new insights into the rates and mechanisms of how crystallographic orientations affect calcite’s dissolution at alkaline pH conditions.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Mechanisms of dissolution from gibbsite step edges elucidated by ab initio molecular dynamics with enhanced sampling

Surface reactions underpin our collective understanding of mineral dissolution. This impacts a range of predictive geochemical models (for weathering, the fate and transport of metals) as well as industrial utilization of minerals. Yet atomistic details are rarely known due to the complex mineral/fluid interfacial environment. There is significant need to understand the mechanistic details of dissolution reactions and how they depend on surface morphology and solution conditions. This work utilizes surface pit models in conjunction with changes to solution composition that mimic pH to explore surface detachment of aluminate from gibbsite, which is a primary source of Al in soils and within the industrial processing of aluminum. Ab initio molecular dynamics simulations with enhanced sampling has been used to explore the detailed process of the detachment, the results of which indicate two potential pathways that are differentiated based upon the extent of water hydration. Here, the heights of the energy barriers depend upon the local morphology which influence the number of bridges (quasi-)simultaneously broken (1 or 2) or the Al-O coordination of the neighboring aluminum atoms (5 or 6) at the armchair edge. pH effects are significant, with a nearly 50% reduction in barrier height under alkaline conditions that are relevant to geothermal fluids and Al extraction from minerals.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Effects of transient thermal shock on the microstructures and corrosion properties of a reduced activation high-entropy alloy

The devices would subject transient thermal shocks (TTS) during operation under extremely harsh conditions of nuclear fusion reactors, which inevitably exert significant impact on the microstructure and performance of structural materials. Here, a reduced activation VCrFeTa 0.2 W 0.2 high-entropy alloy (HEA) was developed by vacuum arc melting. The effects of electron beam induced TTS on its microstructure, microhardness, and corrosion properties were investigated. The results indicate that the weight fraction of each phase changes after TTS, showing a significant decrease in the content of BCC1 phase and an increase in the content of BCC2 and Laves phases. The content of BCC1 phase continues to decrease slightly with increasing the power of TTS. Besides, the microhardness of the alloy increases from ~673 HV to ~714 HV after TTS treatments. In the reduced activation HEA, TTS results in a relatively low corrosion current density of ~0.472 μA/cm 2 in 3.5 wt% NaCl solution, around one-third of the current density observed in the as-cast sample. Furthermore, the VCrFeTa 0.2 W 0.2 HEA after TTS exhibits a pitting potential of ~1.165 V SCE , which is much higher than that of the as-cast sample. The refined composite multiscale entropy method is employed to analyze the influence of TTS on current fluctuation behavior during the corrosion process. The reduced activation VCrFeTa 0.2 W 0.2 HEA exhibits excellent properties in harsh environments after TTS, thereby showing advantageous property in the field of nuclear structural materials. Furthermore, TTS is an efficient and controllable strategy for the improvement of the HEAs’ microstructures and performances.

36 MATERIALS SCIENCE↗

Rapid Coal-Ash Characterization using Geophysical Methods & Machine Learning

Coal combustion products (CCP) are challenging to delineate in heterogeneous field settings. Conventional methods (test pits, coring, and laboratory analyses) are labor-intensive, slow, invasive, and provide sparse spatial coverage. This study evaluates whether rapid non-invasive geophysical screening methods—induced polarization (IP), magnetic susceptibility, and nuclear magnetic resonance (NMR) —combined with surface colorimetry (RGB_24), can discriminate CCP-soil mixtures and provide reliable estimates of CCP content. Laboratory measurements were collected on five CCP-soil mixtures (series) and modeled using (i) a linear baseline, (ii) a calibrated non-linear (power-mean) model, and (iii) a machine-learning (ML) Random Forest approach, with validation via leave-one-series-out and site-specific tests. Across the five series, individual signals—particularly IP and magnetic susceptibility—were strongly predictive of ash content but were consistently outperformed by combined models. The pooled calibrated non-linear and ML models captured the observed non-linearity and achieved high accuracy and precision, improving on linear fits. Colorimetry showed the weakest direct relationship with ash content for the tested samples but improved performance when included in multi-signal models. At pre-selected 3.5% decision threshold, calibrated and ML approaches yielded near-perfect classification (Matthews correlation coefficient ˜ 1), suggesting strong practical operability for field screening. Additionally, field-analog tests highlighted the role of endmembers—accuracy declined without access to end-member measurements but was largely recovered by collecting a minimal labeled pair for local recalibration. With end members, accuracy remained high. Globally trained models performed well on three operational unknowns; however, series-specific refits provided the most accurate predictions. Overall, these results highlight the potential of combining rapid geophysics and minimal local calibration for improved coal-ash delineation.

Peshtani, Klaudio↗

Physical-chemical evaluation of hydraulic fracturing chemicals in the context of produced water treatment

Produced water is a significant waste stream that can be treated and reused; however, the removal of production chemicals—such as those added in hydraulic fracturing—must be addressed. One motivation for treating and reusing produced water is that current disposal methods—typically consisting of deep well injection and percolation in infiltration pits—are being limited. Furthermore, oil and gas production often occurs in arid regions where there is demand for new water sources. Here in this paper, hydraulic fracturing chemical additive data from California are used as a case study where physical-chemical and biodegradation data are summarized and used to screen for appropriate produced water treatment technologies. The data indicate that hydraulic fracturing chemicals are largely treatable; however, data are missing for 24 of the 193 chemical additives identified. More than one-third of organic chemicals have data indicating biodegradability, suggesting biological treatment would be effective. Adsorption-based methods and partitioning of chemicals into oil for subsequent separation is expected to be effective for approximately one-third of chemicals. Volatilization-based treatment methods (e.g. air stripping) will only be effective for approximately 10% of chemicals. Reverse osmosis is a good catch-all with over 70% of organic chemicals expected to be removed efficiently. Other technologies such as electrocoagulation and advanced oxidation are promising but lack demonstration. Chemicals of most concern due to prevalence, toxicity, and lack of data include propargyl alcohol, 2-mercaptoethyl alcohol, tetrakis hydroxymethyl-phosphonium sulfate, thioglycolic acid, 2-bromo-3-nitrilopropionamide, formaldehyde polymers, polymers of acrylic acid, quaternary ammonium compounds, and surfactants (e.g. ethoxylated alcohols). Future studies should examine the fate of hydraulic fracturing chemicals in produced water treatment trains to demonstrate removal and clarify interactions between upstream and downstream processes.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Growth, structure, defects and polarized absorption spectral properties of Er:Yb:YCa{sub 4}O(BO{sub 3}){sub 3} crystals

YCa{sub 4}O(BO{sub 3}){sub 3} (YCOB) crystals co-doped with 3 at% Er{sup 3+} and 20 at% Yb{sup 3+} were successfully grown by the Czochralski method. X-ray powder diffraction (XRPD) results show that the as-grown Er:Yb:YCOB crystal belongs to the monoclinic system with space group Cm. And the lattice parameters are a=8.076(8) Å, b=16.023(7) Å, c=3.528(4) Å and β=101.15(4)°. Crystal defects were revealed by chemical etching experiments. The density of etch pits, attributed to dislocations and observed on (010) planes, was found to be not uniform along the crystal diameter. The detailed polarized absorption spectra were measured. The polarized absorption cross sections at 977 nm are 1.01×10{sup −20}, 1.22×10{sup −20} and 1.05×10{sup −20} cm{sup 2} for E//X, E//Y and E//Z, respectively. And the polarized absorption cross sections at 1538 nm is about 1.86×10{sup −20} cm{sup 2} for both E//X and E//Z, but for E//Y the result is 1.03×10{sup −20} cm{sup 2}, which is much smaller. The relationship between the crystal structure and absorption spectra was discussed. - Graphical abstract: The as-grown bulk Er:Yb:YCOB crystal (the long axis is along the b-axis) and LeBail fit to the XRPD pattern of Er:Yb:YCOB (top) compared to the diffraction pattern of YCOB from the JCPDS data bank (bottom). Reflection markers indicate the calculated reflection positions. The middle trace gives the difference between observed and calculated intensity. Reflection indices corresponding to the strongest diffraction peaks are marked on the experimental pattern. - Highlights: • Er:Yb:YCOB crystal with a new composition was grown. • XRPD and FT-IR showed a certain degree of deformation in the crystal structure. • Detailed polarized absorption cross sections at 977 nm and 1538 nm were calculated. • Crystal defects were clearly revealed by chemical etching experiments.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

An integrated view of the methane system in the pockmarks at Vestnesa Ridge, 79°N

The Vestnesa Ridge is a NW-SE trending, ~ 100 km-long, 1–2 km-thick contourite sediment section located in the Arctic Ocean, west of Svalbard, at 79°N. Pockmarks align along the ridge summit at water depths of ~ 1200 m; they are ~ 700 m in diameter and ~ 10 m deep relative to the surrounding seafloor. Observations of methane seepage in this area have been reported since 2008. In this report we summarize and integrate the available information to date and report on the first detailed seafloor imaging and camera-guided multicore sampling at two of the most active pockmarks along Vestnesa Ridge, named Lomvi and Lunde. We correlate seafloor images with seismically defined subseafloor structures, providing a geological and ecological context to better understand pockmark formation. Subbottom and seismic surveys, water column imaging, geochemical data and seafloor observations indicate ongoing fluid flow at these pockmarks. Visual inspection and sampling using a high-resolution deep-sea camera and multicorer system show exposed gas hydrate and authigenic carbonate in association with biota within two of these pockmarks. Distributed methane venting at both Lomvi and Lunde supports extensive chemosynthetic communities that include filamentous sulfide-oxidizing bacteria and siboglinid tubeworms, all of which utilize chemical energy provided by the seeping fluids. Focused venting forms shallow gas hydrate, and sustains localized gas discharge from 50-m wide pits within the pockmarks. Cycles of carbonate precipitation and/or exhumation of carbonate deposits are indicated by scattered blocks of various size, pavements, and massive carbonate blocks up to 3 m high. Consistent with other observations along continental margin settings, we show that the extensive authigenic carbonate deposits in the Vestnesa pockmarks represent an important and prolonged methane carbon sink that prevents much of the upwardly flowing methane from reaching the overlying ocean.

58 GEOSCIENCES↗

Effect of heat input on the microstructure, residual stresses and corrosion resistance of 304L austenitic stainless steel weldments

Austenitic stainless steels are widely used in high performance pressure vessels, nuclear, chemical, process and medical industry due to their very good corrosion resistance and superior mechanical properties. However, austenitic stainless steels are prone to sensitization when subjected to higher temperatures (673 K to 1173 K) during the manufacturing process (e.g. welding) and/or certain applications (e.g. pressure vessels). During sensitization, chromium in the matrix precipitates out as carbides and intermetallic compounds (sigma, chi and Laves phases) decreasing the corrosion resistance and mechanical properties. In the present investigation, 304L austenitic stainless steel was subjected to different heat inputs by shielded metal arc welding process using a standard 308L electrode. The microstructural developments were characterized by using optical microscopy and electron backscattered diffraction, while the residual stresses were measured by X-ray diffraction using the sin{sup 2}ψ method. It was observed that even at the highest heat input, shielded metal arc welding process does not result in significant precipitation of carbides or intermetallic phases. The ferrite content and grain size increased with increase in heat input. The grain size variation in the fusion zone/heat affected zone was not effectively captured by optical microscopy. This study shows that electron backscattered diffraction is necessary to bring out changes in the grain size quantitatively in the fusion zone/heat affected zone as it can consider twin boundaries as a part of grain in the calculation of grain size. The residual stresses were compressive in nature for the lowest heat input, while they were tensile at the highest heat input near the weld bead. The significant feature of the welded region and the base metal was the presence of a very strong texture. The texture in the heat affected zone was almost random. - Highlights: • Effect of heat input on microstructure, residual stresses and corrosion is studied. • HAZ and width of dendrite in the welded region increase with heat input. • Residual stresses are tensile near the welded region after the highest heat input. • Welded region has the highest pit density after highest heat input. • Dendrites and δ-ferrite were highly oriented in the welded region.

36 MATERIALS SCIENCE↗

The etching process of boron nitride by alkali and alkaline earth fluorides under high pressure and high temperature

Graphical abstract: - Highlights: • Appropriate etch processes of hBN and cBN under HPHT are proposed. • The degree of the crystallization of hBN was decreased. • A special cBN growth mechanism with a triangular unit is proposed. • Plate-shape cBN crystals with large ratio of length to thickness were obtained. • A strategy provides useful guidance for controlling the cBN morphology. - Abstract: Some new etching processes of hexagonal boron nitride (hBN) and cubic boron nitride (cBN) under high pressure and high temperature in the presence of alkali and alkaline earth fluorides have been discussed. It is found that hBN is etched distinctly by alkali and alkaline earth fluorides and the morphology of hBN is significantly changed from plate-shape to spherical-shape. Based on the “graphitization index” values of hBN, the degree of the crystallization of hBN under high pressure and high temperature decreases in the sequence of LiF > CaF{sub 2} > MgF{sub 2}. This facilitates the formation of high-quality cBN single crystals. Different etch steps, pits, and islands are observed on cBN surface, showing the strong etching by alkali and alkaline earth fluorides and the tendency of layer-by-layer growth. A special layer growth mechanism of cBN with a triangular unit has been found. Furthermore, the morphologies of cBN crystals are apparently affected by a preferential surface etching of LiF, CaF{sub 2} and MgF{sub 2}. Respectively, the plate-shape and tetrahedral cBN crystals can be obtained in the presence of different alkali and alkaline earth fluorides.

36 MATERIALS SCIENCE↗

Growth and electrical transport properties of InGaN/GaN heterostructures grown by PAMBE

Highlights: • InGaN thin films were grown on GaN template by PAMBE. • InGaN films were characterized by HRXRD, SEM and PL and Raman spectroscopy. • The indium incorporation in single phase InGaN films was found to be 23%. • The I–V characteristic of the InGaN/GaN heterojunction shows rectifying behavior. • Log–log plot of the I–V characteristics indicates the presence of SCLC mechanism. - Abstract: InGaN epitaxial films were grown on GaN template by plasma-assisted molecular beam epitaxy. The composition of indium incorporation in single phase InGaN film was found to be 23%. The band gap energy of single phase InGaN was found to be ∼2.48 eV. The current–voltage (I–V) characteristic of InGaN/GaN heterojunction was found to be rectifying behavior which shows the presence of Schottky barrier at the interface. Log–log plot of the I–V characteristics under forward bias indicates the current conduction mechanism is dominated by space charge limited current mechanism at higher applied voltage, which is usually caused due to the presence of trapping centers. The room temperature barrier height and the ideality factor of the Schottky junction were found to 0.76 eV and 4.9 respectively. The non-ideality of the Schottky junction may be due to the presence of high pit density and dislocation density in InGaN film.

36 MATERIALS SCIENCE↗

Elucidating the microscopic origin of electrochemical corrosion and electrical conductivity by lattice response to severe plastic deformation in Al-Mn-Si alloy

Highlights: • Al-Mn-Si specimens were underwent severe plastic deformation by CGP and cold-rolling and their combined routes. • Microscopical observations depicted particles' fragmentation and non-preferential distribution under heavy straining. • XRD analysis revealed dislocations annihilation and lattice swelling (d-spacing increase) due to dynamic recrystallization. • Polarization outputs disclosed direct correlation of corrosion behavior with dislocations density. • Four-point probe test proved that electrical conductivity was a function of lattice d-spacing. - Abstract: Al-Mn-Si specimens were underwent SPD by CGP, cold-rolling and their combined paths. Acquired OM and SEM micrographs revealed that random distribution of intermetallic precipitates beside their fragmentation under heavy imposed strains deteriorated particles’ influence on the electrochemical corrosion and inhibited pitting. Analysis of XRD patterns pointed out that post-rolling of CGPed sheets resulted in dynamic annihilation of dislocations and accordingly crystal lattice swelling (d-spacing increase) due to dynamic recrystallization. From polarization results, crystallites’ refinement along with density increment of sub-grain boundaries within structure as a consequence of SPD beside dislocation density enhancement accelerated corrosion. Outputs of four-point probe electrical conductivity examination indicated that apart from the employed processing, lattice compaction and atomic layers approach would limit the electrons’ mobility space and hence reduce the conductivity of material. In this regard, combined effects of CGP and rolling as employed dual-straining route on Al-Mn-Si alloy enhanced the electrical conductivity by d-spacing growth.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

Assessment of the grindability of robocast silicon carbide

The demand for high-performance lightweight optics has driven interest in silicon carbide (SiC) due to its exceptional thermal stability, hardness, and strength-to-weight ratio. This study investigates the potential of robocasting, an additive manufacturing process, as a viable method for producing lightweighted SiC components for optical applications. Four samples with varied starting powder phases (α and β) and sintering conditions were fabricated and evaluated. Post-sintering surface and form were assessed using coherence scanning interferometry (CSI) and coordinate measuring machine (CMM) techniques. A three-stage grinding process was applied to each sample, with surface roughness assessed at each stage. Results demonstrate that samples with predominantly α-phase SiC and smaller particle sizes achieved superior surface finish, particularly sample D2-α-2135 °C, which displayed the lowest post-grinding Sq value of 0.178 µm. The analysis also indicated no significant print-through effect from the lightweighting structure, or print artifacts, at this stage of grinding. However, β-phase samples showed poorer grindability, increased surface roughness, and pitting. These findings suggest that phase composition and particle size are critical for achieving the desired surface quality in robocast SiC optics. Future work will incorporate additional samples and finer grinding wheels to refine surface quality further, supporting the development of SiC for high-precision optical applications.

Barrett, Taylor [ORNL]↗

The in-depth residual strain heterogeneities due to an indentation and a laser shock peening for Ti-6Al-4V titanium alloy

In this paper, heterogeneity of the through-thickness residual strain due to the laser shock peening (LSP) in comparison with that due to the indentation was studied in Ti-6Al-4V alloy samples. The latter is almost a quasi-static process while the former features extremely high strain-rate deformation. The synchrotron based high-energy X-ray diffraction was employed to investigate the through-thickness residual strain distribution. The studied two samples after the two processing procedures share the following features: (i) the pressure affected depths are both ~2 mm and (ii) the largest magnitudes of the compressive residual strains parallel to the surface are ~4,000 με. However, the pit depth for the indentation sample is ~9 times larger than that for the LSP. The position featuring the largest magnitude of the compressive residual strain is in the sub-surface for the indentation while it is in the surface for the LSP. Results of the elastic-visco-plastic finite element simulation for the indentation indicate that the position featuring the maximum accumulative plastic shear as defined in this paper corresponds to the location with the largest magnitude of compressive residual strain. To validate this finding, full width at half maximum (FWHM) of the X-ray diffraction profile, which is proportional to the level of the plastic deformation, is also studied. Finally, it is found that positions with the largest FWHM indeed correspond to the largest magnitude of compressive residual strain for both tests.

36 MATERIALS SCIENCE↗

Measuring the attenuation length of water in the CHIPS-M water Cherenkov detector

The water at the proposed site of the CHIPS water Cherenkov detector has been studied to measure its attenuation length for Cherenkov light as a function of filtering time. A scaled model of the CHIPS detector filled with water from the Wentworth 2W pit, proposed site of the CHIPS deployment, in conjunction with a 3.2 m vertical column filled with this water, was used to study the transmission of 405 nm laser light. Results consistent with attenuation lengths of up to 100 m were observed for this wavelength with filtration and UV sterilization alone.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

The design and construction of the Chips water Cherenkov neutrino detector

Chips (CHerenkov detectors In mine PitS) was a prototype large-scale water Cherenkov detector located in northern Minnesota. The main aim of the R&D project was to demonstrate that construction costs of neutrino oscillation detectors could be reduced by at least an order of magnitude compared to other equivalent experiments. This article presents design features of the Chips detector along with details of the implementation and deployment of the prototype. While issues during and after the deployment of the detector prevented data taking, a number of key concepts and designs were successfully demonstrated.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗