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All sourcesNASA NTRSDOE OSTI
NASA NTRSDate not supplied

Computational Icing Analysis on NASA’s SIDRM Geometry to Investigate Collection Efficiency

Computational icing analysis results were compared to experimental icing tunnel data including aerothermal (e.g. dry air) and supercooled water droplet rime-ice conditions from tests conducted in early 2022 at the NASA Icing Research Tunnel (IRT). The Simulated Intercompressor Duct Research Model (SIDRM) test article was used in this study, and its geometry represents the inter-compressor duct region of a turbofan engine. The test article’s purpose is to study the physics of supercooled water icing and ice crystal icing. This study compared three different icing codes: FENSAP-ICE (Eulerian approach), LEWICE3D (Lagrangian approach), and GlennICE (Lagrangian approach). All three icing codes were conducted on SIDRM’s complex body flow-field and compared to different experimental supercooled water rime runs. The test article instrumentation (pressure taps, thermocouples, etc.) and 3D laser scans of final ice shapes were used to compare against the different icing code simulations. The overall objectives are to understand how the icing codes handle capturing collection efficiency on the complex test article’s unheated surfaces. In the aerothermal cases, pressure tap readings matched the CFD results, but dry air CFD underpredicted thermocouple readings. Collection efficiency results from all three icing codes matched well together on the main body leading edge, main body slope, and the strut leading edges. All three icing codes underpredicted the final ice shape using a single-shot constant ice density approach, with more difficulty coming from the strut leading edge ice shape due to the swept wing like flow field. NASA’s overall goal for this effort is to develop computational icing tools to assist in the design and certification of engines for flight in icing conditions.

Supercooled icing, SIDRM, aerodynamics, computatio↗
NASA NTRS2010

Future Plans in US Flight Missions: Using Laser Remote Sensing for Climate Science Observations

Laser Remote Sensing provides critical climate science observations necessary to better measure, understand, model and predict the Earth's water, carbon and energy cycles. Laser Remote Sensing applications for studying the Earth and other planets include three dimensional mapping of surface topography, canopy height and density, atmospheric measurement of aerosols and trace gases, plume and cloud profiles, and winds measurements. Beyond the science, data from these missions will produce new data products and applications for a multitude of end users including policy makers and urban planners on local, national and global levels. NASA Missions in formulation including Ice, Cloud, and land Elevation Satellite (ICESat 2) and the Deformation, Ecosystem Structure, and Dynamics of Ice (DESDynI), and future missions such as the Active Sensing of CO2 Emissions over Nights, Days and Seasons (ASCENDS), will incorporate the next generation of LIght Detection And Ranging (lidar) instruments to measure changes in the surface elevation of the ice, quantify ecosystem carbon storage due to biomass and its change, and provide critical data on CO 2 in the atmosphere. Goddard's plans for these instruments and potential uses for the resulting data are described below. For the ICESat 2 mission, GSFC is developing a micro-pulse multi-beam lidar. This instrument will provide improved ice elevation estimates over high slope and very rough areas and result in improved lead detection for sea ice estimates. Data about the sea ice and predictions related to sea levels will continue to help inform urban planners as the changes in the polar ice accelerate. DESDynI is planned to be launched in 2017 and includes both lidar and radar instruments. GSFC is responsible for the lidar portion of the DESDynI mission and is developing a scanning laser altimeter that will measure the Earth's topography, the structure of tree canopies, biomass, and surface roughness. The DESDynI lidar will also measure and predict the response of ice masses to climate change and impact on sea level. Data from the lidar will ultimately be fused with radar data products with heretofore unseen results and applications. The 3-D structure of forests is critical to understanding the impact of land use and associated landscape changes on the habitat of life forms and consequently on their biodiversity. Lidar instruments are also under development to measure trace gases in the atmospheric such as CO2 and methane. GSFC is developing an active measurement approach to determine the CO2 column density and surface pressure for the proposed ASCENDS mission. The objective of this approach is to produce data on the amounts of anthropogenic and organic CO2 in the atmosphere with sufficient accuracy to meet the needs of target users including state, federal and international users as well as policy-related legislative, regulatory, and voluntary carbon-related management groups local to international interests. In summary, NASA will continue to rely on laser remote sensing for critical climate science observations and is committed to the development of the next generation of lidar instruments for a range of applications.

Callahan, Lisa W.↗
DOE OSTI2015

2015 Annual Report

For more than 20 years, the Atmospheric Radiation Measurement (ARM) Climate Research Facility has blazed the trail in providing the world’s atmospheric scientists with continuous observations of cloud and aerosol properties and their impacts on Earth’s energy balance. The result is an unprecedented data set that has proved invaluable for understanding the atmosphere and improving the predictive capabilities of earth system models. Over the past year, plans have been put in place to create a powerful new capability for furthering ARM’s mission and achieving the vision outlined in the Decadal Vision, the strategy for the ARM Facility for the next 5 to 10 years. The result is a significant reconfiguration for the ARM Facility that will provide more complete data sets to support process studies and model development. The combined observational and modeling elements will enable a new level of scientific inquiry. To achieve the next-generation ARM Facility, plans underway include the following: Establishing observation “megasites” at the Southern Great Plains and North Slope of Alaska sites Enhancing ARM measurement excellence to support U.S. Department of Energy climate science research Producing routine high-resolution model simulations over domains coincident with ARM sites Developing data products and software tools that facilitate analysis and enable the evaluation of models using ARM data Strengthening interactions with the broader atmospheric science and modeling communities. Changes being implemented at the megasites will provide additional spatial sampling of atmospheric and surface information to support a new ARM capability—the routine operation of high-resolution process models at ARM sites. The result will be even more comprehensive scientific data and the processes and tools for scientists to more easily use ARM data for climate model development.

Southern Great Plains, North Slope of Alaska, larg↗
NASA NTRS2015

The Age of Lunar South Circumpolar Craters Haworth, Shoemaker, Faustini, and Shackleton: Implications for Regional Geology, Surface Processes, and Volatile Sequestration

The interiors of the lunar south circumpolar craters Haworth, Shoemaker, Faustini, and Shackleton contain permanently shadowed regions (PSRs) and have been interpreted to contain sequestered volatiles including water ice. Altimetry data from the Lunar Orbiter Laser Altimeter (LOLA) onboard the Lunar Reconnaissance Orbiter provide a new means of examining the permanently shadowed interiors of these craters in unprecedented detail. In this study, we used extremely high-resolution gridded LOLA data of Haworth, Shoemaker, Faustini, and Shackleton to determine the size-frequency distributions and the spatial density of craters superposing their rims, inner slopes, and floors. Based on their population of superposed D greater than or equal to 2 km craters, Haworth, Shoemaker, and Faustini have pre-Nectarian formation ages. Shackleton is interpreted as having a Late Imbrian age on the basis of craters with diameter D greater than or equal to 0.5 km superposed on its rim. The local density of craters with sub-km diameters across our study area is strongly dependent on slope; because of its steep interior slopes, the lifetime of craters on the interior of Shackleton is limited. The slope-dependence of the small crater population implies that the population in this size range is controlled primarily by the rate at which craters are destroyed. This is consistent with the hypothesis that crater removal and resurfacing is a result of slopedependent processes such as diffusive mass wasting and seismic shaking, linked to micrometeorite and meteorite bombardment. Epithermal neutron flux data and UV albedo data show that these circumpolar PSRs, particularly Shoemaker, may have approximately 1-2% water ice by mass in their highly porous surface regolith, and that Shoemaker may have approximately 5% or more water ice by mass in the near subsurface. The ancient formation ages of Shoemaker, Faustini and Haworth, and the Late Imbrian (approximately 3.5 Ga) crater retention ages of their floors suggests that any water ice that might have been deposited in their permanently shadowed areas was insufficient to modify the superposed crater population since that time.

Circumpolar↗
DOE OSTI2017

ZFIRE: similar stellar growth in hα-emitting cluster and field galaxies at z ∼ 2

We compare galaxy scaling relations as a function of environment at z∼2 with our ZFIRE survey{sup 12} where we have measured Hα fluxes for 90 star-forming galaxies selected from a mass-limited (log(M{sub ⋆}/M{sub ⊙})>9) sample based on ZFOURGE.{sup 13} The cluster galaxies (37) are part of a confirmed system at z = 2.095 and the field galaxies (53) are at 1.9 2 × 10{sup 11} L{sub ⊙}). Because the luminous IR galaxies in our combined sample are ∼5 times more massive than the low-IR galaxies, their radii are ∼70% larger. To track stellar growth, we separate galaxies into those that lie above, on, or below the Hα star-forming main sequence (SFMS) using ΔSFR(M{sub ⋆}) = ±0.2 dex. Galaxies above the SFMS (starbursts) tend to have higher Hα SFR surface densities and younger light-weighted stellar ages than galaxies below the SFMS. Our results indicate that starbursts (+SFMS) in the cluster and field at z∼2 are growing their stellar cores. Lastly, we compare to the (SFR–M{sub ⋆}) relation from Rhapsody-G cluster simulations and find that the predicted slope is nominally consistent with the observations. However, the predicted cluster SFRs tend to be too low by a factor of ∼2, which seems to be a common problem for simulations across environment.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2017

Simulation of the Effect of Contact Area Loss in All-Solid-State Li-Ion Batteries

Maintaining the physical contact between the solid electrolyte and the electrode is important to improve the performance of all-solid-state batteries. Imperfect contact can be formed during cell fabrication and will be worsened due to cycling, resulting in degradation of the battery performance. In this paper, the effect of imperfect contact area was incorporated into a 1-D Newman battery model by assuming the current and Li concentration will be localized at the contacted area. Constant current discharging processes at different rates and contact areas were simulated for a film-type Li|LiPON|LiCoO 2 all-solid-state Li-ion battery. The capacity drop was correlated with the contact area loss. It was found at lower cutoff voltage, the correlation is almost linear with a slope of 1; while at a higher cutoff voltage, the dropping rate is slower. To establish the relationship between the applied pressure and the contact area, Persson's contact mechanics theory was applied, as it uses self-affined surfaces to simplify the multi-length scale contacts in all-solid-state batteries. The contact area and pressure were computed for both film-type and bulk-type all-solid-state Li-ion batteries. The model is then used to suggest how much pressures should be applied to recover the capacity drop due to contact area loss.

25 ENERGY STORAGE↗
DOE OSTI2026

Surface Energy Balance System (SEBS) Instrument Handbook

A surface energy balance system (SEBS) has been installed collocated with each deployed eddy correlation flux measurement system (ECOR) after 2010 at the U.S. Department of Energy (DOE) Atmospheric Radiation Measurement (ARM) User Facility Southern Great Plains (SGP) observatory, North Slope of Alaska (NSA) observatory, Eastern North Atlantic (ENA) observatory, and the first, second, and third ARM Mobile Facilities (AMF1, AMF2, AMF3). A SEBS was also deployed at the Tropical Western Pacific (TWP) site, before it was decommissioned. Data from these sites, including the retired TWP, are available in the ARM Data Center. The SEBS consists of upwelling and downwelling solar and infrared radiometers within one net radiometer, a wetness sensor, and soil temperature, soil moisture, and soil heat flow measurements. The SEBS measurements allow the comparison of ECOR sensible and latent heat fluxes with the energy balance determined from the SEBS and provide information on wetting of the sensors for data quality purposes.

54 ENVIRONMENTAL SCIENCES↗
NASA NTRS1983

Lifting surface theory for a helicopter rotor in forward flight

A lifting surface theory has been developed for a helicopter rotor in forward flight for incompressible flow. The method utilized the concept of the linearized acceleration potential and make use of the vortex lattice procedures. Results in terms of lift coefficient slope for several forward flight conditions are given.

Runyan, H. L.↗
NASA NTRS1987

Biharmonic spline interpolation of GEOS-3 and Seasat altimeter data

An algorithm is presented for determining the minimum curvature surface passing through a set of nonuniformly spaced data points. The curve is generated as a linear combination of Green functions for the biharmonic operator at each data point, with the amplitudes of the functions adjusted so that the interpolating surfaces passes through each point. The function passing through the points can be regarded as a spline to which point forces are applied, defining the minimum curvature between the points. The technique was used to combine the along track slopes of the GEOS-3 and Seasat altimeter data into a consistent geoid height map of the Caribbean area, covering 0.5 million data points in the process. Sample images are provided and new topographic features that are revealed are discussed.

Sandwell, David T.↗
NASA NTRS2012

Can We Infer Ocean Dynamics from Altimeter Wavenumber Spectra?

The wavenumber spectra of sea surface height (SSH) and kinetic energy (KE) have been used to infer the dynamics of the ocean. When quasi-geostrophic dynamics (QG) or surface quasi-geostrophic (SQG) turbulence dominate and an inertial subrange exists, a steep SSH wavenumber spectrum is expected with k-5 for QG turbulence and a flatter k-11/3 for SQG turbulence. However, inspection of the spectral slopes in the mesoscale band of 70 to 250 km shows that the altimeter wavenumber slopes typically are much flatter than the QG or SQG predictions over most of the ocean. Comparison of the altimeter wavenumber spectra with the spectra estimated from the output of an eddy resolving global ocean circulation model (the Hybrid Coordinate Ocean Model, HYCOM, at 1/25 resolution), which is forced by high frequency winds and includes the astronomical forcing of the sun and the moon, suggests that the flatter slopes of the altimeter may arise from three possible sources, the presence of internal waves, the lack of an inertial subrange in the 70 to 250 km band and noise or submesoscales at small scales. When the wavenumber spectra of SSH and KE are estimated near the internal tide generating regions, the resulting spectra are much flatter than the expectations of QG or SQG theory. If the height and velocity variability are separated into low frequency (periods greater than 2 days) and high frequency (periods less than a day), then a different pattern emerges with a relatively flat wavenumber spectrum at high frequency and a steeper wavenumber spectrum at low frequency. The stationary internal tides can be removed from the altimeter spectrum, which steepens the spectral slopes in the energetic internal wave regions. Away from generating regions where the internal waves

Richman, James↗
NASA NTRS1993

Three-dimensional numerical simulation of near-surface flows over the Martian north polar cap

Measurements made by Viking Lander VL-2 (48 N) have shown that the near-surface wind and temperature regime on Mars displays striking similarities to terrestrial counterparts. The diurnal radiative cycle is responsible for establishment of a well-defined thermal circulation in which downslope (Katabatic) flows prevail during the nighttime hours and weak upslope (anabatic) conditions prevail during the daytime. Previous work has indicated that the slope flows are much like those found on Earth, particularly the Katabatic winds, which show striking similarities to drainage flows observed over Antarctica. The low-level wind regime appears to be an important factor in the scouring of the martian landscape. The north polar cap shows evidence of eolian features such as dunes, frost streaks, and grooves from Viking imagery. The direction of the prevailing wind can in cases be inferred from the eolian features. We examine the thermally induced flows that result from the radiative heating and cooling of the martian north polar region using a comprehensive three-dimensional atmospheric mesoscale numerical model. The same model has been used previously for simulation of Antarctic Katabatic winds. The model equations are written in terrain-following coordinates to allow for irregular terrain; prognostic equations include the flux forms of the horizontal momentum equations, temperature, continuity. A surface energy budget equation is also incorporated in which the surface temperature is determined. Explicit parameterization of both terrestrial (longwave) and solar (shortwave) radiation is included. Turbulent transfer of heat and momentum in the martian atmosphere is assumed to follow the similarity expressions in the surface boundary layer on Earth. The terrain heights for the martian north polar region have been obtained from the U.S. Geological Survey map and digitized onto a 57x57 grid with a spacing of 75 km. The resulting terrain map is shown in Fig. 1. The vertical grid consists of 15 levels (delta equals 0.998, 0.99, 0.98, 0.97, 0.96, 0.94, 0.92, 0.90, 0.85, 0.775, 0.70, 0.60, 0.50, 0.30, 0.10). The high resolution in the lower atmosphere is necessary to capture details of the boundary layer flows. The lowest level corresponds to a height of approximately 20 m above the ground, the seconds level 100 m.

Parish, Thomas R.↗
NASA NTRS1984

Surface compositions in the Aristarchus Region: Implications for regional stratigraphy

Near infrared reflectance spectra for the Aristachus region, obtained using the 2.2m UH telescope at the Mauna Kea Observatory, were reduced and analyzed. The spectra obtained for the central peak, southern floor, southwestern wall, eastern wall, and northwestern wall of Aristachus crater exhibit shallow continuum slopes, relatively strong feldspar bands, pyroxene bands stronger than those typically seen in the spectra of fresh higland features, and pyroxene band centers near l micrometer suggesting the dominance of Ca rich clinopyroxene. The spectrum of the south rim of Aristachus is quite distinct from those of other crater units. The position of Aristrchus on the plateau/mare boundary raises questions concerning compositional variations in crater ejects deposits.

Hawke, H. R.↗
NASA NTRS2001

Improvements in AVHRR Daytime Cloud Detection Over the ARM NSA Site

Clouds play an important role in the radiation budget over Arctic and Antarctic. Because of limited surface observing capabilities, it is necessary to detect clouds over large areas using satellite imagery. At low and mid-latitudes, satellite-observed visible (VIS; 0.65 micrometers) and infrared (IR; 11 micrometers) radiance data are used to derive cloud fraction, temperature, and optical depth. However, the extreme variability in the VIS surface albedo makes the detection of clouds from satellite a difficult process in polar regions. The IR data often show that the surface is nearly the same temperature or even colder than clouds, further complicating cloud detection. Also, the boundary layer can have large areas of haze, thin fog, or diamond dust that are not seen in standard satellite imagery. Other spectral radiances measured by satellite imagers provide additional information that can be used to more accurately discriminate clouds from snow and ice. Most techniques currently use a fixed reflectance or temperature threshold to decide between clouds and clear snow. Using a subjective approach, Minnis et al. (2001) found that the clear snow radiance signatures vary as a function of viewing and illumination conditions as well as snow condition. To routinely process satellite imagery over polar regions with an automated algorithm, it is necessary to account for this angular variability and the change in the background reflectance as snow melts, vegetation grows over land, and melt ponds form on pack ice. This paper documents the initial satellite-based cloud product over the Atmospheric Radiation Measurement (ARM) North Slope of Alaska (NSA) site at Barrow for use by the modeling community. Cloud amount and height are determined subjectively using an adaptation of the methodology of Minnis et al. (2001) and the radiation fields arc determined following the methods of Doelling et al. (2001) as applied to data taken during the Surface Heat and Energy Budget of the Arctic (SHEBA). The procedures and data produced in this empirically based analysis will also facilitate the development of the automated algorithm for future processing of satellite data over the ARM NSA domain. Results are presented for May, June, and July 1998. ARM surface data are use to partially validate the results taken directly over the ARM site.

Chakrapani, V.↗
NASA NTRS2024

A Decade of Salt Marsh Elevation Change in New York City’s Coastal Urban Parks

Coastal salt marshes of the eastern United States are particularly vulnerable to accelerated sea level rise, and urban marshes are at greater risk of erosion, inundation, and conversion to mudflat if left unmanaged. To guide New York City (NYC) salt marsh restoration strategies, NYC Parks collected up to 10 years of salt marsh elevation change data through 2020 at six salt marsh sites using the Surface Elevation Table-Marker Horizon (SET-MH) method, conducted a salt marsh trends analysis to determine shoreline change from 1974 to 2012, and conducted a salt marsh conditions assessment. We found that the citywide average surface elevation trend of 3.31 mm yr −1 was not significantly different from the 30-year (1990–2020) Relative Sea Level Rise of 4.23 mm yr −1 at The Battery, NY, tide station, probably due to high variability across and within sites. We also found that accretion rates differed across sites and watersheds, and sites situated lower in the tidal zone had higher accretion rates. Notably, Jamaica Bay’s Idlewild salt marsh, long suspected of being sediment-starved and ranking lowest in our conditions assessment, had the highest accretion rate at 9.5 mm yr −1 . Our salt marsh trends analysis also showed marsh loss at the shoreline edge, bare ground cover, and other indicators of marsh degradation. In mitigating marsh loss, the design grades for our recent wetland restoration projects enlarge the upper elevation ranges of the low- and high-marsh zones and incorporate wider and more gradual slopes in upland transition zones to enable inland marsh migration.

Salt marsh elevation change↗
DOE OSTI2021

Comparison of fiber-optic distributed temperature sensing and high-sensitivity sensor spatial surveying of stream temperature

Measuring surface water temperature spatial variability is needed to estimate the interaction between surface water and groundwater, evaluate fish habitat and thermal inertia, and to estimate streamflow frequency and duration. Fiber optic distributed temperature sensing (FO-DTS) has been used in rivers and lakes, providing high-resolution and sensitive temperature monitoring over large temporal and spatial scales. However, in streams with cobbly or bedrock-lined streambeds and variable bathymetry, use of FO-DTS to measure temperature close to the surface water and groundwater interface can be challenging if even feasible. FO-DTS can also be costly, involve difficult installations, and require an advanced understanding of the technology, calibration, and data processing. In this study, we compared FO-DTS stream temperature survey results to an alternative temperature survey method employing a towed transect of high-resolution temperature loggers spaced at 1-m and transported in the stream along the study reach, to measure the spatial distribution of stream-water temperature in East Fork Poplar Creek near Oak Ridge, Tennessee, USA. We assessed the applicability and limitations of the two methods, and quantitatively compared in-situ temperature survey results measured simultaneously with each method. Regression results showed strong temporal and spatial correlation between the two methods. Differences were only elevated near the stream banks in areas that were coincident with correlation slope deviations from unity, which was attributed to shallower water and lower data density. Kriging standard errors were also low at channel center with minor increases near the stream banks. Furthermore, the results suggested that the array of the individual temperature sensors can provide a practical alternative to FO-DTS for thermal characterization of surface water, providing slightly lower spatial and temporal resolution, but with higher accuracy of temperature measurement, with greater simplicity, and with a broader range of conditions where it may be applied.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2016

Imaging of surface nanobubbles by atomic force microscopy in liquids: Influence of drive frequency on the characterization of ultrasoft matter: Surface Nanobubbles and Soft Matter by AFM

Imaging of soft matter with atomic force microscopy (AFM) is challenging due to tip-induced deformation, which convolutes with the measurement. The challenges are generally more serious in liquid environments due to a severe loss of sensitivity of the vibrating microcantilever to external forces, as well as due to the presence of undesirable mechanical resonances when piezoelectric excitation systems are used. Furthermore, the choice of imaging parameters can have a significant impact on the quality of the results, such that the customary practices used for tuning the cantilever are not always appropriate. Here we explore the influence of the chosen drive frequency on the imaging of ultrasoft matter, using surface gas nanobubbles on gold-coated glass and highly oriented pyrolytic graphite (HOPG) as a test platform. We carry out single- and multifrequency AFM experiments using both the traditional amplitude-peak method and the recently proposed phase-slope-peak method for tuning the cantilever, as well as piezoelectric and photothermal excitation, providing an extensive discussion on the factors governing the level of tip-induced sample deformation and the quality of the phase contrast obtained for each of the methods. The general conclusion is that there is no “one-size-fits-all” approach for tuning the cantilever for low-impact tapping-mode AFM, although rational optimization of the imaging process is generally possible, whereby the choice of the drive frequency plays a prominent role. The physical insight and guidelines provided here can be extremely useful for the gentle imaging of a wide range of biological and other soft materials in liquid environments. Microsc. Res. Tech. 80:41–49, 2017.

42 ENGINEERING↗
DOE OSTI2023

Dual carbonate clumped isotopes (Δ 47 -Δ 48 ) constrains kinetic effects and timescales in peridotite-associated springs at the Cedars, Northern California

The Cedars is an area in Northern California with a chain of highly alkaline springs resulting from CO 2 -charged meteorological water interacting with a peridotite body. Serpentinization resulting from this interaction at depth leads to the sequestration of various carbonate minerals into veins accompanied by a release of Ca 2+ and OH – enriched water to the surface, creating an environment which promotes rapid precipitation of CaCO 3 at surface springs. This environment enables us to apply the recently developed Δ 47 -Δ 48 dual clumped isotope analysis to probe kinetic isotope effects (KIEs) and timescales of CO 2 transformation in a region with the potential for geological CO 2 sequestration. Here, we analyzed CaCO 3 recovered from various localities and identified significant kinetic fractionations associated with CO 2 absorption in a majority of samples, characterized by enrichment in Δ 47 values and depletion in Δ 48 values relative to equilibrium. Surface floes exhibited the largest KIEs (ΔΔ 47 : 0.163‰, ΔΔ 48 : -0.761‰). Surface floe samples begin to precipitate out of solution within the first hour of CO 2 absorption, and the dissolved inorganic carbon (DIC) pool requires a residence time of >100 h to achieve isotopic equilibria. The Δ 48 /Δ 47 slope of samples from the Cedars (-3.223 ± 0.519) is within the range of published theoretical values designed to constrain CO 2 hydrolysis-related kinetic fractionation (-1.724 to -8.330). The Δ 47 /δ 18 O slope (-0.009 ± 0.001) and Δ 47 /δ 13 C slope (-0.009 ± 0.001) are roughly consistent with literature values reported from a peridotite in Oman of -0.006 ± 0.002 and -0.005 ± 0.002, respectively. The consistency of slopes in the multi-isotope space suggests the Δ 47 -Δ 48 dual carbonate clumped isotope framework can be applied to study CO 2 -absorption processes in applied systems, including sites of interest for geological sequestration.

58 GEOSCIENCES↗
DOE OSTI2019

Enormous electron-electron scattering in the filled-cage cubic compound B a 10 T i 24 B i 39

Cubic intermetallic compound Ba 10 Ti 24 Bi 39 has a Ba 6 Bi 16 polyhedral cage with a Bi guest atom encapsulated inside. The compound can be formulated as Ba 5 Ti 12 Bi$_{19+x}$ when $x$ signifies the extra Bi atoms filling cages. It crystallizes in a complex noncentrosymmetric cubic structure in space group $P-43m$ with cell parameter $a = 12.6787(4)Å$. The guest Bi atoms distribute diffusely in the cages and seem to play a role in stabilizing the crystal structure. The magnetic susceptibility of this compound shows a weak temperature dependence with a positive slope coefficient. The charge transport properties as a function of temperature exhibit two competing components which are in charge of positive and negative magnetoresistances. Electronic band-structure calculations reveal the complex multiband hybridization of Ti/Bi orbitals near the Fermi surface, which may play a role in the enormous electron-electron scattering in this material evidenced by the large Kadowaki-Woods ratio.

36 MATERIALS SCIENCE↗