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Neutron Radiography and Computed Tomography of Biological Systems at the Oak Ridge National Laboratory's High Flux Isotope Reactor

Neutrons have historically been used for a broad range of biological applications employing techniques such as small-angle neutron scattering, neutron spin echo, diffraction, and inelastic scattering. Unlike neutron scattering techniques that obtain information in reciprocal space, attenuation-based neutron imaging measures a signal in real space that is resolved on the order of tens of micrometers. The principle of neutron imaging follows the Beer-Lambert law and is based on the measurement of the bulk neutron attenuation through a sample. Greater attenuation is exhibited by some light elements (most notably, hydrogen), which are major components of biological samples. Contrast agents such as deuterium, gadolinium, or lithium compounds can be used to enhance contrast in a similar fashion as it is done in medical imaging, including techniques such as optical imaging, magnetic resonance imaging, X-ray, and positron emission tomography. For biological systems, neutron radiography and computed tomography have increasingly been used to investigate the complexity of the underground plant root network, its interaction with soils, and the dynamics of water flux in situ. Moreover, efforts to understand contrast details in animal samples, such as soft tissues and bones, have been explored. This manuscript focuses on the advances in neutron bioimaging such as sample preparation, instrumentation, data acquisition strategy, and data analysis using the High Flux Isotope Reactor CG-1D neutron imaging beamline. The aforementioned capabilities will be illustrated using a selection of examples in plant physiology (herbaceous plant/root/soil system) and biomedical applications (rat femur and mouse lung).

Bilheux, Hassina↗

Laboratory synthesis of C3S on the kilogram scale

An optimized process using amorphous silica for efficient C{sub 3}S synthesis in the laboratory is reported: an estimated production capacity of ~2 kg C{sub 3}S within a week is possible. Amorphous silica (fumed silica) was used as raw material and inter-ground with CaCO{sub 3} and water for C{sub 3}S synthesis, the dried raw mixture has sufficient green strength to be self-supporting, which allows large cylinders to be placed in Platinum crucibles. The mineral composition of the sintered sample was quantified with X-ray powder diffraction using Rietveld analysis. C{sub 3}S with 3 S synthesis was dramatically enhanced because of 1) increased burnability of the raw mix due to amorphous silica and very fine CaCO{sub 3} particles after grinding, 2) simplified sample preparation process avoiding pressing discs and 3) improved capacities of the crucible and furnace.

36 MATERIALS SCIENCE↗

X-ray scaling relations of “core” and “coreless” E and S0 galaxies

We have re-examined the two X-ray scaling relations of early-type galaxies (ETGs), L{sub X,GAS}–L{sub K} and L{sub X,GAS}–T{sub GAS}, using 61 ATLAS{sup 3D} E and S0 galaxies observed with Chandra (including ROSAT results for a few X-ray bright galaxies with extended hot gas). With this sample, which doubles the number of ETGs available for study we confirm the strong, steep correlations reported by Boroson et al. Moreover, the larger sample allows us to investigate the effect of structural and dynamical properties of ETGs in these relations. Using the sub-sample of 11 “genuine” E galaxies with central surface brightness cores, slow stellar rotations and old stellar populations, we find that the scatter of the correlations is strongly reduced, yielding an extremely tight relation of the form L{sub X,GAS} ∼ T{sub GAS}{sup 4.5±0.3}. The rms deviation is only 0.13 dex. For the gas-rich galaxies in this sample (L{sub X,GAS} > 10{sup 40} erg s{sup −1}), this relation is consistent with recent simulations for velocity dispersion supported E galaxies. However, the tight L{sub X,GAS}–T{sub GAS} relation of genuine E galaxies extends down into the L{sub X} ∼ 10{sup 38} erg s{sup −1} range, where simulations predict the gas to be in outflow/wind state, with resulting L{sub X} much lower than observed in our sample. The observed correlation may suggest the presence of small bound hot halos even in this low luminosity range. At the high luminosity end, the L{sub X,GAS}–T{sub GAS} correlation of core elliptical galaxies is similar to that found in samples of cD galaxies and groups, but shifted down toward relatively lower L{sub X,GAS} for a given T{sub GAS}. In particular cDs, central dominant galaxies sitting at the bottom of the potential well imposed by the group dark matter, have an order of magnitude higher L{sub X,GAS} than our sample core galaxies for the same L{sub K} and T{sub GAS}. We suggest that enhanced cooling in cDs, which have higher hot gas densities and lower entropies, could lower T{sub GAS} to the range observed in giant Es; this conclusion is supported by the presence of extended cold gas in several cDs. Instead, in the sub-sample of coreless ETGs—these galaxies also tend to show stellar rotation, a flattened galaxy figure and rejuvenation of the stellar population—L{sub X,GAS} and T{sub GAS} are not correlated. The L{sub X}−T{sub GAS} distribution of coreless ETGs is a scatter diagram clustered at L{sub X,GAS} < 10{sup 40} erg s{sup −1}, similar to that reported for the hot interstellar medium (ISM) of spiral galaxies, suggesting that both the energy input from star formation and the effect of galactic rotation and flattening may disrupt the hot ISM.

79 ASTRONOMY AND ASTROPHYSICS↗

Effect of Aluminum Titanate (Al 2 TiO 5 ) Doping on the Mechanical Performance of Solid Oxide Fuel Cell Ni-YSZ Anode

The mechanical behavior of un-doped and 1–10 wt.% aluminum titanate doped NiO-YSZ anodes was evaluated in the oxidized and reduced state of the material. Sample bars 25 × 5 × 2 mm were fabricated and tested in a three-point bending apparatus and statistical analyzes of the collected data were performed. A remarkable enhancement of the flexural strength was found both for the reduced and oxidized state of the material when compared to the un-doped samples. In both cases, the development of a secondary phase was observed proportional to the doping amount of aluminum titanate. Morphological analysis along with preliminary phase identification and suspected mechanisms for strength enhancement are presented and discussed.

25 ENERGY STORAGE↗

Host Galaxy Properties of the Swift BAT Ultra Hard X-Ray Selected AGN

We have assembled the largest sample of ultra hard X-ray selected (14-195 keV) AGN with host galaxy optical data to date, with 185 nearby (z<0.05), moderate luminosity AGN from the Swift Burst Alert Telescope (BAT) sample. The BAT AGN host galaxies have intermediate optical colors (u -- r and g -- r) that are bluer than a comparison sample of inactive galaxies and optically selected AGN from the Sloan Digital Sky Survey (SDSS) which are chosen to have the same stellar mass. Based on morphological classifications from the RC3 and the Galaxy Zoo, the bluer colors of BAT AGN are mainly due to a higher fraction of mergers and massive spirals than in the comparison samples. BAT AGN in massive galaxies (log Stellar Mass >10.5) have a 5 to 10 times higher rate of spiral morphologies than in SDSS AGN or inactive galaxies. We also see enhanced far-IR emission in BAT AGN suggestive of higher levels of star formation compared to the comparison samples. BAT AGN are preferentially found in the most massive host galaxies with high concentration indexes indicative of large bulge-to-disk ratios and large supermassive black holes. The narrow-line (NL) BAT AGN have similar intrinsic luminosities as the SDSS NL Seyferts based on measurements of [O III] Lambda 5007. There is also a correlation between the stellar mass and X-ray emission. The BAT AGN in mergers have bluer colors and greater ultra hard X-ray emission compared to the BAT sample as whole. In agreement with the Unified Model of AGN, and the relatively unbiased nature of the BAT sources, the host galaxy colors and morphologies are independent of measures of obscuration such as X-ray column density or Seyfert type. The high fraction of massive spiral galaxies and galaxy mergers in BAT AGN suggest that host galaxy morphology is related to the activation and fueling of local AGN.

Koss, Michael↗

ENERGY DEPOSITION PROFILES AND ENTROPY IN GALAXY CLUSTERS

We report the results of our study of fractional entropy enhancement in the intracluster medium (ICM) of the clusters from the representative XMM-Newton cluster structure survey. We compare the observed entropy profile of these clusters with that expected for the ICM without any feedback, as well as with the introduction of preheating and cooling. We make the first estimate of the total, as well as radial, non-gravitational energy deposition up to r {sub 500} for this large, nearly flux-limited, sample of clusters. We find that the total energy deposition corresponding to the entropy enhancement is proportional to the cluster temperature (and hence cluster mass). The energy deposition per particle scaled by T {sub sp}, {Delta}E/T {sub sp} has a similar profile in all clusters, and is more pronounced in the central regions. Our results support models of entropy enhancement through active galactic nucleus feedback.

79 ASTRONOMY AND ASTROPHYSICS↗

Enhanced adhesion from high energy ion irradiation

It has been found that the adhesion of thin metal films on insulators, semiconductors, and metals could be improved by subjecting the material to a high-energy ion bombardment. Griffith et al. (1982) have first suggested a use of this technique with insulators. The present investigation has the objective to determine the mechanism for the adhesion enhancement. A description is presented of a preliminary transmission electron microscopy (TEM) study of thinned bonded samples of silver on silicon using electron diffraction. It is found that irradiation of a variety of thin film-substrate combinations by heavy ion beams will provide a remarkable improvement in the adherence of the film. The evidence for the mechanism involved in the enhancement of adhesion is discussed.

Werner, B. T.↗

Effects of rare earth ionic doping on microstructures and electrical properties of CaCu{sub 3}Ti{sub 4}O{sub 12} ceramics

Graphical abstract: The dielectric constant decreases monotonically with reduced RE doping ion radius and is more frequency independent compared with that of pure CCTO sample. - Highlights: • The mean grain sizes decrease monotonically with reduced RE doping ionic radius. • Doping gives rise to the monotonic decrease of ϵ{sub r} with reduced RE ionic radius. • The nonlinear coefficient and breakdown field increase with RE ionic doping. • α of all the samples is associated with the potential barrier width rather than Φ{sub b}. - Abstract: Ca{sub 1–x}R{sub x}Cu{sub 3}Ti{sub 4}O{sub 12}(R = La, Nd, Eu, Gd, Er; x = 0 and 0.005) ceramics were prepared by the conventional solid-state method. The influences of rare earth (RE) ion doping on the microstructure, dielectric and electrical properties of CaCu{sub 3}Ti{sub 4}O{sub 12} (CCTO) ceramics were investigated systematically. Single-phase formation is confirmed by XRD analyses. The mean grain size decreases monotonically with reduced RE ion radius. The EDS results reveal that RE ionic doping reduces Cu-rich phase segregation at the grain boundaries (GBs). Doping gives rise to the monotonic decrease of dielectric constant with reduced RE ionic radius but significantly improves stability with frequency. The lower dielectric loss of doped samples is obtained due to the increase of GB resistance. In addition, the nonlinear coefficient and breakdown field increase with RE ionic doping. Both the fine grains and the enhancement of potential barrier at GBs are responsible for the improvement of the nonlinear current–voltage properties in doped CCTO samples.

36 MATERIALS SCIENCE↗

Novel hydrothermal method for effective doping of N and F into nano Titania for both, energy and environmental applications

Highlights: • Novel method to synthesize N, F doped TiO{sub 2} via hydrothermal method is discussed. • Change in bandgap of TiO{sub 2} upon doping makes a photocatalyst visible active. • 94% of degradation of EtBr was achieved within a less time of 90 min. • The doped titania also showed good efficiency as photo anodic material for solar cell. - Abstract: A novel and an efficient hydrothermal method for the preparation of an effective doped titania photocatalyst is reported. The crystal phase, binding energy, elemental composition, morphology, optical and electronic structure analyses were done by various techniques. The doped titania proved as an efficient electrode material and photocatalyst for solar cells and water treatment respectively. The photocatalyst is able to degrade the most potent mutagen ethidium bromide under sunlight with an enhancement of 1.6 times over its undoped analogue. As photo-anode material, showed an improved open circuit potential and fill factor. The created electron states in the doped sample act as charge carrier traps suppressing recombination which later detraps the same to the surface of the catalyst causing enhanced interfacial charge transfer. Surface acidity caused by F induction and lowered band gap energy that can respond to visible light facilitates improved energy harvesting and energy transfer leading to better photo activity.

36 MATERIALS SCIENCE↗

Electric field enhanced diffusion welding of alloy 617: Microstructural characteristics and mechanical properties

This study investigated the microstructural characteristics and mechanical behavior of diffusion welded nickel-based Alloy 617 obtained by electric field-assisted sintering (EFAS) using various parameters. The interfacial microstructure exhibited different characteristics including good grain boundary (GB) migration across the interface in the samples diffusion-welded at 1100 °C and a flat interface in the samples joined at 1000 °C and 1050 °C. The interface consisted of fine Al 2 O 3 oxides, while precipitation of interfacial M 23 C 6 carbides was not observed. Grain boundaries migrated across the Al 2 O 3 oxides, leaving these oxides within the grains. Graded grain size was observed, with grain coarsening being more significant near the sample surface due to the temperature gradient induced by EFAS. Tensile testing revealed that the specimens fractured in the matrix away from the interface, indicting strong diffusion-welded joints. Further, the peak tensile strength of 807 MPa was obtained in the samples welded at 1000 °C due to minimal grain growth. The materials obtained at 1100 °C exhibited reduced tensile strength but improved ductility. Strain maps revealed by digital image correlation showed alternating high and low strain segments in the samples produced at 1000 °C and 1050 °C, indicating that the flat interfaces with no GB migration were less ductile compared to the matrix. A greater strain uniformity was observed along the bond interfaces with improved GB migration. The hardness reduced near the sample surfaces due to enlarged grains induced by temperature gradient. This study demonstrates that GB migration and enhanced mechanical strength can be achieved in diffusion-welded Alloy 617.

36 MATERIALS SCIENCE↗

Design Enhancements of the Fourier Kelvin Stellar Interferometer to Enable Detection of Earth Twins

During the last few years, considerable effort has been directed towards very large-scale (> $5 billion) missions to detect and characterize Mars-radius to Earth-radius planets around nearby stars; such as the Terrestrial Planet Finder Interferometer and Darwin missions. However, technological issues such as formation flying and control of systematic noise sources will likely prevent these missions from entering Phase A until at least the end of the next decade. Presently more than 350 planets have been discovered by a variety of techniques, and little is known about the majority of them other than their approximate mass. However, a simplified nulling interferometer operating in the near- to mid-infrared (e.g. approx. 5-15 microns), like the enhanced version of the Fourier Kelvin Stellar Interferometer (FKSI), can characterize the atmospheres of a large sample of the known planets - including Earth twins. Many other scientific problems can be addressed with a system like FKSI, including the studies of debris disks, active galactic nuclei, and low mass companions around nearby stars. We report results of a recent engineering study on an enhanced version of FKSI that includes 1-meter primary mirrors, 20-meter boom length, and an advanced sun shield that will provide a 45-degree FOR and 40K operating temperature for all optics including siderostats.

Barry, Richard K.↗

Using Neural Networks for Low Energy Reconstruction and Neutron Identification in the MicroBooNE LArTPC

Identifying and reconstructing final-state neutrons from neutrino interactions in Liquid Argon Time Projection Chambers (LArTPCs) will enhance future oscillation measurements by recovering missing energy and improving neutrino interaction channel identification. However, neutrons are challenging to reconstruct as the majority leave only small, isolated charge signatures known as blips. Here we present initial efforts to identify neutrons in the MicroBooNE LArTPC with low energy protons from neutron-argon inelastic interactions that present as blips below the traditional tracking threshold in the TPC. Unlike for tracks, there is no algorithmic method to determine direction for blips since they span only a few wires. Therefore, we developed and trained a Recurrent Neural Network (RNN) to reconstruct the directionality of proton-induced blips, allowing us to separate signal from background by selecting blips that point back to the neutrino vertex. The model achieves a preliminary average angular resolution of 17 degrees when tested on a simulated sample of protons over 6 MeV in kinetic energy. This novel tool will enhance neutron detection in LArTPCs and expand a broad range of other low-energy physics searches such as for solar and supernova neutrinos.

Silva, Liani Isabel [Unlisted, US]↗

Using Ambient Ion Beams to Write Nanostructured Patterns for Surface Enhanced Raman Spectroscopy

Electrolytic spray deposition was used to pattern surfaces with 2D metallic nanostructures. Spots that contain silver nanoparticles (AgNP) were created by landing solvated silver ions at desired locations using electrically floated masks to focus the metal ions to an area as little as 20 mm in diameter. The AgNPs formed are unprotected and their aggregates can be used for surface-enhanced Raman spectroscopy (SERS). The morphology and SERS activity of the NP structures were controlled by the surface coverage of landed silver ions. The NP structures created could be used as substrates onto which SERS samples were deposited or prepared directly on top of predeposited samples of interest. The evenly distributed hot spots in the micron-sized aggregates had an average SERS enhancement factor of 108. The surfaces showed SERS activity when using lasers of different wavelengths (532, 633, and 785 nm) and were stable in air.

Environmental Molecular Sciences Laboratory↗

Coherency strain enhanced dielectric-temperature property of rare-earth doped BaTiO{sub 3}

Core/shell-grained BaTiO{sub 3} samples were prepared with addition of rare earth elements. The core/shell interface was semi-coherent, and many misfit dislocations formed in Dy-doped samples. In contrast, a coherent interface and few dislocations were observed in Ho- and Er-doped samples. Dy-doped samples exhibited poor temperature stability, showing a peak with no frequency dispersion. Ho- and Er-doped samples exhibited a broad curve with frequency dispersion. This improved temperature stability is attributed to the coherency strain, which leads to the formation of polar nano-regions in the shell. Coherency at the core/shell interface is critical to improve the temperature stability of core/shell-structured BaTiO{sub 3}.

36 MATERIALS SCIENCE↗

Casting of Reinforced Concrete Beam: Project Progress

Aging concrete structures in nuclear power plants undergo mechanical, physical, chemical, and radioactive degradation. One of the chemical degradation mechanisms that is investigated in the research project under the Plant Modernization Pathway of the Light Water Reactor Sustainability Program is the alkali-silica reaction (ASR). The ASR is a chemical process that over time, causes expansion of calcium silicate hydrate gel. To date, the research project has studied the ASR gel formation and expansion in non-reinforced concrete specimens using vibro-acoustic modulation (VAM) technique. However, nuclear plant concrete structures are reinforced, and it might influence the application of VAM technique on reinforced concrete specimens compared to non-reinforced specimens. A research activity is initiated between Idaho National Laboratory, Vanderbilt University, and University of Nebraska - Lincoln to study the impact of reinforcement in concrete structures on the application of the VAM technique. To support this activity, University of Nebraska - Lincoln is casting and curing four reinforced concrete samples that at the end of the curing period will be transferred to Vanderbilt University to perform experimental VAM study. Vanderbilt University and Idaho National Laboratory will perform the data analysis and enhance the developed structural health monitoring framework. In this report, a progress on casting and curing of reinforced concrete samples at University of Nebraska – Lincoln is provided.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

The Global Precipitation Mission

The Global Precipitation Mission (GPM), expected to begin around 2006, is a follow-up to the Tropical Rainfall Measuring Mission (TRMM). Unlike TRMM, which primarily samples the tropics, GPM will sample both the tropics and mid-latitudes. The primary, or core, satellite will be a single, enhanced TRMM satellite that can quantify the 3-D spatial distributions of precipitation and its associated latent heat release. The core satellite will be complemented by a constellation of very small and inexpensive drones with passive microwave instruments that will sample the rainfall with sufficient frequency to be not only of climate interest, but also have local, short-term impacts by providing global rainfall coverage at approx. 3 h intervals. The data is expected to have substantial impact upon quantitative precipitation estimation/forecasting and data assimilation into global and mesoscale numerical models. Based upon previous studies of rainfall data assimilation, GPM is expected to lead to significant improvements in forecasts of extratropical and tropical cyclones. For example, GPM rainfall data can provide improved initialization of frontal systems over the Pacific and Atlantic Oceans. The purpose of this talk is to provide information about GPM to the USWRP (U.S. Weather Research Program) community and to discuss impacts on quantitative precipitation estimation/forecasting and data assimilation.

Braun, Scott↗

The MPLEx Protocol for Multi-omic Analyses of Soil Samples

Mass spectrometry (MS)-based integrated metaproteomic, metabolomic and lipidomic (multi-omic) studies are transforming our ability to understand and characterize microbial communities in environmental and biological systems. These measurements are even enabling enhanced analyses of complex soil microbial communities, which are the most complex microbial systems known to date. Multi-omic analyses, however, do have sample preparation challenges since separate extractions are typically needed for each omic study, thereby greatly amplifying the preparation time and amount of sample required. To address this limitation, a 3-in-1 method for simultaneous metabolite, protein, and lipid extraction (MPLEx) from the exact same soil sample was created by adapting a solvent-based approach. This MPLEx protocol has proven to be simple yet robust for many sample types and even when utilized for limited quantities of complex soil samples. The MPLEx method also greatly enabled the rapid multi-omic measurements needed to gain a better understanding of the members of each microbial community, while evaluating the changes taking place upon biological and environmental perturbations.

Environmental Molecular Sciences Laboratory↗

Temperature-dependent cavity swelling in dual-ion irradiated Fe and Fe-Cr ferritic alloys

Fe-Cr ferritic-martensitic (FM) steels are promising structural material candidates for fusion and advanced fission reactors due to their attractive mechanical properties and volumetric swelling resistance. However, significant discrepancies exist regarding the effect of solutes and irradiation temperature on cavity swelling under ion versus neutron irradiation conditions. In this study, simultaneous dual ion irradiations (8 MeV Ni 3+ ions and energy-degraded 3.5 MeV He 2+ ions) were used to quantify the cavity swelling behavior in ultra-high purity Fe and Fe-Cr alloys (3-14 wt.% Cr), Fe-10 wt.% Cr-780 wt.ppm C, and Eurofer97 FM steel. The irradiations were conducted over a wide temperature range (400-550°C) with a mid-range dose of ~30 displacements per atom (dpa) and 0.1 appm/dpa He implantation rate. Here, using state-of-the-art transmission electron microscopy (TEM), we reveal that pure Fe has a ~50°C lower peak swelling temperature difference than Fe-Cr alloys, which is attributed to higher vacancy mobility in pure Fe. Chromium solute appears to strongly suppress cavity swelling in Fe-Cr alloys for temperatures below ~470°C, but seems to have little effect or slightly enhances swelling above ~470°C. Cavities were observed in all the irradiated samples between 400-550°C. This indicates that the narrow temperature range of observable cavities reported in prior ion irradiated Fe-Cr ferritic alloy studies is likely an artifact associated with the use of low ion energies (<5 MeV), which leads to pronounced near-surface and implanted ion effects that suppress cavity swelling even at midrange depths (particularly at high temperatures).

36 MATERIALS SCIENCE↗