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At least 829 records · Page 46

Modeling copper precipitation hardening and embrittlement in a dilute Fe-0.3at.%Cu alloy under neutron irradiation

The neutron irradiation in light water reactors can induce precipitation of nanometer sized Cu clusters in reactor pressure vessel steels. The Cu precipitates impede dislocation gliding, leading to increase of yield strength (hardening) and upward shift of ductile-to-brittle transition temperature (embrittlement). In this work, cluster dynamics modeling is used to model the entire Cu precipitation process (nucleation, growth, and coarsening) in a Fe-0.3at.%Cu alloy under neutron irradiation at 300 °C. The evolution of the Cu cluster number density and mean radius predicted by the modeling agrees well with experimental data reported in literature for the same alloy under the same irradiation conditions. The predicted precipitation kinetics are used as input for a dispersed barrier hardening model to correlate the microstructural evolution with the radiation hardening and embrittlement in this alloy. The predicted radiation hardening agrees well with the mechanical test results in literature. In conclusion, the limitation of the model and future improvement directions are also discussed in this work.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

An additively manufactured AlCuMnZr alloy microstructure and tensile mechanical properties

In this study, selective laser melting (SLM) was used to fabricate an AlCuMnZr alloy. The microstructural features that resulted from additive manufacturing (AM) were significantly refined compared to the corresponding cast alloy features. A combination of fine equiaxed and columnar grains along with in-situ formation of θ' precipitates during AM leads to enhanced yield strength (up to 300°C) in the as-fabricated AM alloy. The refinement of brittle intermetallics and a bimodal grain size distribution leads to improved tensile elongation in the AM alloy. The results illustrate the microstructural advantages that can result from additive processing over conventionally processed microstructures.

36 MATERIALS SCIENCE↗

Stable isotopes composition of precipitation fallen over Cluj-Napoca, Romania, between 2009-2012

The paper presents the deuterium and oxygen 18 content from All precipitations events, which have occured over Cluj-Napoca, Romania from 2009 until 2012. Time series for δ{sup 2}H and δ{sup 18}O values point out both the seasonal variation that has increased amplitude reflecting the continental character of the local climate as well as dramatic variations of isotopic content of successive precipitation events, emphasizing the anomalous values. These fluctuations are the footprint of the variations and trends in climate events. Local Meteoric Water Line (LMWL), reflecting the δ{sup 2}H - δ{sup 18}O correlation, has the slop and the intercept slightly deviated from the GMWL, indicating that the dominant process affecting local precipitations are close to the equilibrium condition. LMWL has a slope smaller then that of the GMWL in the warm season due to lower humidity and a slope closest to the slop of GMWL in cold season with high humidity. The δ{sup 2}H and δ{sup 18}O values both for the precipitation events and monthly mean values are positively correlated with the temperature values with a very good correlation factor. The values of δ{sup 2}H and δ{sup 18}O are not correlated with amount of precipitation, the 'amount effect' of isotopic composition of precipitation is not observed for this site.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Understanding the Roles of Convective Trigger Functions in the Diurnal Cycle of Precipitation in the NCAR CAM5

The wrong diurnal cycle of precipitation is a common weakness of current global climate models (GCMs). To improve the simulation of the diurnal cycle of precipitation and understand what physical processes control it, we test a convective trigger function described in Xie et al. (2019) with additional optimizations in the NCAR Community Atmosphere Model version 5 (CAM5). The revised trigger function consists of three modifications: 1) replacing the Convective Available Potential Energy (CAPE) trigger with a dynamic CAPE (dCAPE) trigger, 2) allowing convection to originate above the top of planetary boundary layer (i.e., the unrestricted air parcel launch level - ULL), and 3) optimizing the entrainment rate and threshold value of the dynamic CAPE generation rate for convection onset based on observations. Results from 1°-resolution simulations show that the revised trigger can alleviate the long-standing GCM problem of too early maximum precipitation during the day and missing the nocturnal precipitation peak that is observed in many regions, including the U.S. southern Great Plains (SGP). The revised trigger also improves the simulation of the propagation of precipitation systems downstream of the Rockies and the Amazon region. A further composite analysis over the SGP unravels the mechanisms through which the revised trigger affects convection. Additional sensitivity tests show that both the peak time and the amplitude of the diurnal cycle of precipitation are sensitive to the entrainment rate and dCAPE threshold values.

54 ENVIRONMENTAL SCIENCES↗

A hierarchical analysis of the impact of methodological decisions on statistical downscaling of daily precipitation and air temperatures

Despite the widespread application of statistical downscaling tools, uncertainty remains regarding the role of model formulation in determining model skill for daily maximum and minimum temperature (Tmax and Tmin), and precipitation occurrence and intensity. Impacts of several key aspects of statistical transfer function form on model skill are evaluated using a framework resistant to model overspecification. We focus on: (a) model structure: simple (generalized linear models, GLMs) versus complex (artificial neural networks, ANNs) models. (b) Predictor selection: Fixed number of predictors chosen a priori versus stepwise selection of predictors and inclusion of grid point values versus predictors derived from application of principal components analysis (PCA) to spatial fields. We also examine the influence of domain size on model performance. For precipitation downscaling, we consider the role of the threshold used to characterize a wet day and apply three approaches (Poisson and Gamma distributions in GLM and ANN) to downscale wet-day precipitation amounts. While no downscaling formulation is optimal for all predictands and at 10 locations representing diverse U.S. climates, and due to the exclusion of variance inflation all of the downscaling formulations fail to reproduce the range of observed variability, models with larger suites of prospective predictors generally have higher skill. For temperature downscaling, ANNs generally outperform GLM, with greater improvements for T min than T max . Furthermore, use of PCA-derived predictors does not systematically improve model skill, but does improve skill for temperature extremes. Model skill for precipitation occurrence generally increases as the wet-day threshold increases and models using PCA-derived predictors tend to outperform those based on grid cell predictors. Each model for wet-day precipitation intensity overestimates annual total precipitation and underestimates the proportion derived from extreme precipitation events, but ANN-based models and those with larger predictor suites tend to have the smallest bias.

54 ENVIRONMENTAL SCIENCES↗

The Role of Atmospheric Rivers on Groundwater: Lessons Learned From an Extreme Wet Year

Abstract In the coastal regions of the western United States, atmospheric rivers (ARs) are associated with the largest precipitation generating storms and contribute up to half of annual precipitation, but the impact of ARs on the integrated hydrologic cycle, specifically on groundwater storage and hydrodynamics, is largely unknown. To better explore the hydrologic behavior of AR versus non‐AR event precipitation, we present a novel combination of two water tracking methods (one in the atmosphere and one in the subsurface) to explicitly track the full lifecycle of water parcels generated by ARs. Simulations of northern California's Cosumnes River watershed during the record wet 2017 water year are performed via the coupling of a high‐resolution regional climate model and a land surface‐groundwater model accounting for lateral groundwater flow. Despite ARs contributing more precipitation than non‐AR storms, we find less AR water is preferentially stored in aquifers by year end. Fractionally, ARs result in 300% less snow derived groundwater‐recharged compared to non‐AR precipitation. Rain‐on‐snow (RoS) plays an important role in AR‐driven discharge, where over 50% of total discharge from ARs snow is from RoS events. Finally, despite record‐breaking annual precipitation, simulated groundwater depletion occurs by year end due to estimates of groundwater pumping activities. The results from these simulations serve as a partial analogue of future hydrologic conditions where ARs are expected to intensify and provide a greater fraction of annual precipitation due to climate change.

54 ENVIRONMENTAL SCIENCES↗

Hydrothermal synthesis and formation mechanism of hexagonal yttrium hydroxide fluoride nanobundles

Graphical abstract: The formation of yttrium hydroxide fluorides nanobundles can be expressed as a precipitation transformation from cubic NaYF{sub 4} to hexagonal NaYF{sub 4} and to hexagonal Y(OH){sub 2.02}F{sub 0.98} owing to ion exchange. - Highlights: • Novel Y(OH){sub 2.02}F{sub 0.98} nanobundles have been successfully prepared by hydrothermal method. • The branched nanobundles composed of numerous oriented-attached nanoparticles has been studied. • The growth mechanism is proposed to be ion exchange and precipitation transformation. - Abstract: This article presents the fabrication of hexagonal yttrium hydroxide fluoride nanobundles via one-pot hydrothermal process, using yttrium nitrate, sodium hydroxide and ammonia fluoride as raw materials to react in propanetriol solvent. The X-ray diffraction pattern clearly reveals that the grown product is pure yttrium hydroxide fluoride, namely Y(OH){sub 2.02}F{sub 0.98}. The morphology and microstructure of the synthesized product is testified to be nanobundles composed of numerous oriented-attached nanoparticles as observed from the field emission scanning electron microscopy (FESEM). The chemical composition was analyzed by the energy dispersive spectrum (EDS), confirming the phase transformation of the products which was clearly consistent with the result of XRD analysis. It is proposed that the growth of yttrium hydroxide fluoride nanobundles be attributed to ion exchange and precipitation transformation.

36 MATERIALS SCIENCE↗

Melting and solidification dynamics during laser melting of reaction-based metal matrix composites uncovered by in-situ synchrotron X-ray diffraction

Laser additive manufacturing (AM) of reaction-based metal matrix composites (MMCs) involves highly complex and non-equilibrium material transformation behavior, including melting, dissolution, precipitation, and solidification. Yet, the dynamics and interplay of these phase transformation processes remain poorly understood, posing substantial challenges in identifying the microstructure formation mechanism, and predicting and controlling the microstructure in the printed parts. Here, in this study, we performed the in-situ X-ray diffraction experiment to characterize the phase evolution dynamics of the 316L + 10 vol.%TiC system during laser melting, which provides direct and quantitative insights of the complex phase reaction and evolution dynamics under rapid heating and cooling conditions relevant to additive manufacturing of reaction-based MMCs. Further in-depth thermodynamic and kinetic calculations revealed that most of the phase evolution behavior observed in the in-situ X-ray diffraction experiment cannot be solely explained by widely used equilibrium thermodynamic models, and diffusion-controlled nonequilibrium dissolution and precipitation kinetics must be considered to elucidate the complex phase evolution behavior, including incomplete TiC dissolution, and three-step TiC precipitation. The three distinct types of precipitates generate unique hierarchical TiC micro- and nanostructures, which enhances the yield strength from 513 MPa to 877 MPa by 71 %, tensile strength from 628 MPa to 1054 MPa by 68 %, and Young's modulus from 193 GPa to 221 GPa by 14 %. The findings of our research provide the knowledge foundation for the design of unique microstructures and advanced MMC materials through laser AM.

36 MATERIALS SCIENCE↗

Ductile failure X-prize.

Fracture or tearing of ductile metals is a pervasive engineering concern, yet accurate prediction of the critical conditions of fracture remains elusive. Sandia National Laboratories has been developing and implementing several new modeling methodologies to address problems in fracture, including both new physical models and new numerical schemes. The present study provides a double-blind quantitative assessment of several computational capabilities including tearing parameters embedded in a conventional finite element code, localization elements, extended finite elements (XFEM), and peridynamics. For this assessment, each of four teams reported blind predictions for three challenge problems spanning crack initiation and crack propagation. After predictions had been reported, the predictions were compared to experimentally observed behavior. The metal alloys for these three problems were aluminum alloy 2024-T3 and precipitation hardened stainless steel PH13-8Mo H950. The predictive accuracies of the various methods are demonstrated, and the potential sources of error are discussed.

36 MATERIALS SCIENCE↗

The effect of finish rolling temperature and tempering on the microstructure, mechanical properties and dislocation density of direct-quenched steel

Highlights: • The effect of thermomechanical treatment and tempering on direct-quenched steel has been studied. • Dislocation density of direct-quenched and tempered martensite is evaluated using both TEM and Williamson-Hall method. • Statistical analysis has been performed to study the effect of different factors on toughness of direct-quenched martensite. - Abstract: A unique batch tempering treatment for industrial scale direct-quenched steel coils has been studied using laboratory simulations. The tempering treatment was non-isothermal with slow heating to 570 °C and slow cooling to simulate the tempering of large steel coils. The paper presents the effect of finishing rolling temperature (FRT) relative to the non-recrystallization temperature (T{sub NR}) and the effect of long time tempering on the microstructure, dislocation density and mechanical properties of direct-quenched coiled strips. Conditioning austenite below the recrystallization stop temperature resulted in a finer effective grain size distribution, which correlated strongly with the impact toughness of the final product. Furthermore low finish rolling temperature resulted in partially ferritic microstructures while higher finishing rolling temperatures led to mixtures of bainite and martensite. Dislocation densities determined with TEM and XRD showed somewhat different trends regarding the effect of tempering: intra-lath dislocation density, as measured with TEM, showed a statistically significant drop in only one case, while XRD analysis indicated a drop in all cases. Furthermore, no significant correlation between finishing rolling temperature and dislocation density existed in XRD studies. The XRD results indicate that the decrease in dislocation density corresponds to about 100 MPa lower dislocation strengthening. However, precipitation hardening and potential internal micro stress relief compensates this as yield strength remains unchanged or even increases during tempering.

36 MATERIALS SCIENCE↗

Observations Pertaining to Precipitation within the Northeast Pacific Stratocumulus-to-Cumulus Transition

Three genuine stratocumulus-to-cumulus transitions sampled during the Cloud System Evolution over the Trades (CSET) campaign are documented. The focus is on Lagrangian evolution of in situ precipitation, thought to exceed radar/lidar retrieved values because of Mie scattering. Two of the three initial stratocumulus cases are pristine [cloud droplet number concentrations ($N_d$) of ~22 cm –3 ] but occupied boundary layers of different depths, while the third is polluted ($N_d$ ~ 225 cm –3 ). Hourly satellite-derived cloud fraction along Lagrangian trajectories indicate that more quickly deepening boundary layers tend to transition faster, into more intense but more occasional precipitation. These transitions begin either in the morning or late afternoon, suggesting that preceding night processes can precondition or delay the inevitable transition. The precipitation shifts toward larger drop sizes throughout the transition as the boundary layers deepen, with aerosol concentrations only diminishing in two of the three cases. Ultraclean ($N_d$ < 1 cm –3 ) cumulus clouds evolved from pristine stratocumulus cloud with unusually high precipitation rates occupying a shallow, well-mixed boundary layer. Results from a simple one-dimensional evaporation model and from radar/lidar retrievals suggest subcloud evaporation likely increases throughout the transition. This, coupled with larger drop sizes capable of lowering the latent cooling profile, facilitates the transition to more surface-driven convection. The coassociation between boundary layer depth and precipitation does not provide definitive conclusions on the isolated effect of precipitation on the pace of the transition. Differences between the initial conditions of the three examples provide opportunities for further modeling studies.

54 ENVIRONMENTAL SCIENCES↗

Explore GPM IMERG and Other Global Precipitation Products with GES DISC GIOVANNI

New features and capabilities in the newly released GIOVANNI allow exploring GPM IMERG (Integrated Multi-satelliE Retrievals for GPM) Early, Late and Final Run global half-hourly and monthly precipitation products as well as other precipitation products distributed by the GES DISC such as TRMM Multi-Satellite Precipitation Analysis (TMPA), MERRA (Modern Era Retrospective-Analysis for Research and Applications), NLDAS (North American Land Data Assimilation Systems), GLDAS (Global Land Data Assimilation Systems), etc. GIOVANNI is a web-based tool developed by the GES DISC (Goddard Earth Sciences and Data Information Services Center) to visualize and analyze Earth science data without having to download data and software. The new interface in GIOVANNI allows searching and filtering precipitation products from different NASA missions and projects and expands the capabilities to inter-compare different precipitation products in one interface. Knowing differences in precipitation products is important to identify issues in retrieval algorithms, biases, uncertainties, etc. Due to different formats, data structures, units and so on, it is not easy to inter-compare precipitation products. Newly added features and capabilities (unit conversion, regridding, etc.) in GIOVANNI make inter-comparisons possible. In this presentation, we will describe these new features and capabilities along with examples.

Giovanni↗

Decadal Seasonal Shifts of Precipitation and Temperature in TRMM and AIRS Data

We present results from an analysis of seasonal phase shifts in the global precipitation and surface temperatures. We use data from the TRMM (Tropical Rainfall Measuring Mission) Multi-satellite Precipitation Algorithm (TMPA), and the Atmospheric Infrared Sounder (AIRS) on Aqua satellite, all hosted at NASA Goddard Earth Science Data and Information Services Center (GES DISC). We explore the information content and data usability by first aggregating daily grids from the entire records of both missions to pentad (5-day) series which are then processed using Singular Value Decomposition approach. A strength of this approach is the normalized principal components that can then be easily converted from real to complex time series. Thus, we can separate the most informative, the seasonal, components and analyze unambiguously for potential seasonal phase drifts. TMPA and AIRS records represent correspondingly 20 and 15 years of data, which allows us to run simple “phase learning†from the first 5 years of records and use it as reference. The most recent 5 years are then phase-compared with the reference. We demonstrate that the seasonal phase of global precipitation and surface temperatures has been stable in the past two decades. However, a small global trend of delayed precipitation, and earlier arrival of surface temperatures seasons, are detectable at 95% confidence level. Larger phase shifts are detectable at regional level, in regions recognizable from the Eigen vectors to having strong seasonal patterns. For instance, in Central North America, including the North American Monsoon region, confident phase shifts of 1-2 days per decade are detected at 95% confidence level. While seemingly symbolic, these shifts are indicative of larger changes in the Earth Climate System. We thus also demonstrate a potential usability scenario of Earth Science Data Records curated at the NASA GES DISC in partnership with Earth Science Missions.

surface temperatures↗

Evaluation of strain caused by coherent precipitates in an Al alloy using TEM techniques

Elastic strains, caused by GP zones in an aged Al alloy, were determined quantitatively using two techniques: Dark Field In-line Holography (DFH) and High Resolution Transmission Electron Microscopy-Geometric Phase Analysis (HRTEM-GPA). The results obtained by both techniques showed that the elastic strain was not uniform along the precipitate-matrix interface. In some areas, it was found that strain had negligible value and this was attributed to the loss of coherence between the lattices. It is suggested that a possible explanation for this fact could be a variation in the 'vacancies pump mechanism' kinetics. To obtain a better interpretation of the experimental deformation maps, a reference GP precipitate-matrix structure was built using QSTEM software. The main advantages of DFH over HRTEM-GPA were a bigger field of view and low electron dose requirements without spatial resolution loss. Another difference found was that crystalline defects such as dislocations were evidenced by HRTEM-GPA in contrast to the result obtained by DFH. However, strain measurements were affected by mask size effect in the former. - Highlights: Black-Right-Pointing-Pointer Strain around GP precipitates was not uniform and was in a more relaxed state. Black-Right-Pointing-Pointer Strain values determined by HRTEM had more artifacts compared with holography ones. Black-Right-Pointing-Pointer Strain distribution was attributed to differences in the release of vacancies. Black-Right-Pointing-Pointer Holography showed important advantages over HRTEM regarding field of view mainly.

36 MATERIALS SCIENCE↗

Kinetics of Ni Sorption in Soils: Roles of Soil Organic Matter and Ni Precipitation

The kinetics of Ni sorption to two Delaware agricultural soils were studied to quantitatively assess the relative importance of Ni adsorption on soil organic matter (SOM) and the formation of Ni layered double hydroxide (Ni-LDH) precipitates using both experimental studies and kinetic modeling. Batch sorption kinetic experiments were conducted with both soils at pH 6.0, 7.0, and 7.5 from 24 h up to 1 month. Time-resolved Ni speciation in soils was determined by X-ray absorption spectroscopy (XAS) during the kinetic experiments. A kinetics model was developed to describe Ni kinetic reactions under various reaction conditions and time scales, which integrated Ni adsorption on SOM with Ni-LDH precipitation in soils. The soil Ni speciation (adsorbed phases and Ni-LDH) calculated using the kinetics model was consistent with that obtained through XAS analysis during the sorption processes. Under our experimental conditions, both modeling and XAS results demonstrated that Ni adsorption on SOM was dominant in the short term and the formation of Ni-LDH precipitates accounted for the long-term Ni sequestration in soils, and, more interestingly, that the adsorbed Ni may slowly transfer to Ni-LDH phases with longer reaction times.

54 ENVIRONMENTAL SCIENCES↗

Reactive transport modelling of a cement backfill for radioactive waste disposal

Cementitious materials are included in many geological disposal facilities for radioactive wastes, including the UK candidate backfill material Nirex Reference Vault Backfill (NRVB). As part of an ongoing programme of work to assess NRVB performance, 1-D reactive-transport models have been constructed to simulate reaction with different illustrative groundwater compositions. Variant cases were also produced to explore the effect of model assumptions on the predicted behaviour of the backfill. Depending on groundwater composition, cement alteration pathways included: carbonation; external sulphate attack; chloride attack; the formation of magnesium-rich solids; and the precipitation of secondary aluminosilicate minerals. In general, the models suggest that the pore space in backfill associated with radioactive waste disposal systems is likely to become clogged (to some degree) over time close to backfill-rock interfaces resulting in a reduction in capacity for solute transport. However, the models do not include all relevant process couplings which is potentially, an area for further work.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Study of the microstructure evolution of heat treated Ti-rich NiTi shape memory alloy

Martensitic evolution in Ti-rich NiTi alloy, Ti50.5Ni49.5, has been investigated as a function of annealing, solution treatment and a combination thereof and a detailed electron microscopic investigation carried out. Self-accommodated martensite plates resulted in all heat treated samples. Martensitic < 011 > type II twins, which are common in NiTi shape memory alloys, was found in both as-received and heat-treated samples. Solution treated samples, additionally, showed {11-1} type I twinning was also found in samples that have been annealed after solution-treatment. Another common feature of the microstructure in both as-received and heat treated samples is the formation of Ti{sub 2}Ni precipitates. The size, number and dispersions of these precipitates can be controlled by resorting to a suitable heat treatment e.g. solution treatment.

36 MATERIALS SCIENCE↗

Strengthening of nanocrystalline Al using grain boundary solute additions: Effects of thermal annealing and ion irradiation

Strengthening of nanocrystalline Al by grain boundary solute additions was investigated for a series of dilute aluminum alloys, Al-Sc, Al-Sb, Al-Cr, and Al-W with grain sizes in the range of 50–200 nm. Thermal annealing of the alloys at low temperatures led to alloy softening, but with negligible change in the grain size. The re- duction in strength can be attributed to the loss of solute in the grain boundaries arising from grain boundary diffusion and precipitation. Annealing at higher temperatures led to grain growth, but with little additional loss of strength, a result of precipitation hardening. The Al-Sc and Al-Sb alloys were additionally subjected to ion irradiation at various temperatures. Furthermore, these studies revealed that annealed samples regained their hardness due to solute redistribution by ion beam mixing. Alloy strength was independent of grain size between 50 and 150 nms. Irradiation-induced segregation of Sb to grain boundaries in Al-Sb further enhanced strengthening.

36 MATERIALS SCIENCE↗