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At least 307 records · Page 17

Preparation of high density heavy metal fluoride glasses with extended ultraviolet and infra red ranges, and such high density heavy metal fluoride glasses

A heavy metal fluoride glass composition range (in mol percent) consisting essentially of: (16-30)BaF.sub.2.(8-26)HfF.sub.4.(6-24)InF.sub.3 or GaF.sub.3.(4-16)CdF.sub.2.(6-24)YbF.sub.3.(4-22)ZnF.sub.2. In an alternative embodiment, a heavy metal fluoride glass composition range (in mol percent) comprises (16-30)BaF.sub.2.(8-26)HfF.sub.4.(6-24) of (0-24)InF.sub.3, (0-24)GaF.sub.3 and (0-19)AlF.sub.3.(1-16)CdF.sub.2.(6-24)YbF.sub.3.(4-26)ZnF.sub.2. A preferred heavy metal fluoride glass produced in accordance with the present invention comprises a composition (in mol %) and comprises about 26BaF.sub.2.18HfF.sub.4.7InF.sub.3.5GaF.sub.3.10CdF.sub.2.18YbF.sub.3. 16ZnF.sub.2. A preferred heavy metal fluoride glass has maximum thickness of most preferably about 3 mm. Another preferred heavy metal fluoride glass comprises a composition (in mol %) and comprises about 26BaF.sub.2.18HfF.sub.4.12AlF.sub.3.10CdF.sub.2.18YbF.sub.3.16ZnF.sub.2.

Martin, Steven W.↗

Nuclear kinetic density from ab initio theory

The nuclear kinetic density is one of many fundamental, nonobservable quantities in density functional theory (DFT) dependent on the nonlocal nuclear density. Often, approximations may be made when computing the density that may result in spurious contributions in other DFT quantities. With the ability to compute the nonlocal nuclear density from ab initio wave functions, it is now possible to estimate effects of such spurious contributions. Herein, we derive the kinetic density using ab initio nonlocal scalar one-body nuclear densities computed within the no-core shell model (NCSM) approach, utilizing two- and three-nucleon chiral interactions as the sole input. The ability to compute translationally invariant nonlocal densities allows us to gauge the impact of the spurious center-of-mass (c.m.) contributions in DFT quantities, such as the kinetic density, and provide ab initio insight into refining energy density functionals. The nonlocal nuclear densities are derived from the NCSM one-body densities calculated in second quantization. We present a review of c.m. contaminated and translationally invariant nuclear densities. We then derive an analytic expression for the kinetic density using these nonlocal densities, producing an ab initio kinetic density. The ground-state nonlocal densities of He 4 , 6 , 8 , C 12 , and O 16 are used to compute the kinetic densities of the aforementioned nuclei. The impact of c.m. removal techniques in the density are discussed and compared to a procedure applied in DFT. The results of this work can be extended to other fundamental quantities in DFT. The use of a general nonlocal density allows for the calculation of fundamental quantities taken as input in theories such as DFT. This allows benchmarking c.m. removal procedures and provides a bridge for comparison between ab initio and DFT many-body techniques.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Composition-Based Density Model for High Level Waste Glasses

In this report, the Savannah River National Laboratory (SRNL) provides a first-principles model capable of predicting the density of high-level waste (HLW) glass based on the glass composition. The model relies on the additivity of the specific volume of bound glass oxides to obtain a quantitative evaluation of the approximate glass density. A database of glass densities and compositions was compiled from various sources including previous Defense Waste Processing Facility (DWPF) variability study glasses, HLW studies from other institutions, and literature references. There are a total of 1104 glass compositions in the database with densities ranging from 2.224 g/cm 3 to 3.997 g/cm 3 . The breadth of the compositional coverage space is reported as well. A predictive method was investigated in which the glass density was calculated as a function of the weighted partial molar volumes of the individual glass oxides and the molar mass of the glass. This method yielded a high correlation between the predicted density and the measured density. In addition, a linear regression of these predictions indicated that the predicted value was equal to the measured within the bounds of analytical uncertainty. The following conclusions were drawn from the results of these analyses: 1. Measured glass density is highly correlated with glass composition (R 2 ≈ 0.95). 2. The correlation between glass density and glass composition can be expressed as either: a. A weighted sum of the individual oxide glass-component densities, or b. A weighted sum of the individual oxide glass-component partial molar volumes. 3. A linear regression of the predicted density via partial molar volume method to the measured density yields a slope of 0.9975 and an intercept of -0.0007 – the uncertainty interval associated with these coefficients contain one and zero, respectively. 4. The fitted coefficients and associated uncertainty intervals of the linear regression of the predicted density via the partial molar volume method to the measured density suggest that the predicted theoretical density is, within analysis uncertainty, equal to the measured density of the glass. It is recommended that glass density measurements included with the variability study for each sludge batch be discontinued. In their place, SRNL will calculate a bounding glass density value for the frit/sludge system using the model. It is also recommended that DWPF implement the density model as part of the fissile loading determination portion of the SME acceptability process. Details for implementation are provided in this report.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Raccoon density estimation from camera traps for raccoon rabies management

Abstract Density estimation for unmarked animals is particularly challenging, yet density estimates are often necessary for effective wildlife management. Raccoons ( Procyon lotor ) are the primary terrestrial wildlife reservoir for Lyssavirus rabies within the United States. The raccoon rabies variant (RRVV) is actively managed at landscape scales using oral rabies vaccination (ORV) within the eastern United States. To effectively manage RRVV, it is important to know the density of raccoons to appropriately scale the density of ORV baits distributed on the landscape. We compared methods to estimate raccoon densities from camera‐trap data versus more intensive capture‐mark‐recapture (CMR) estimates across 2 land cover types (upland pine and bottomland hardwood) in the southeastern United States during 2019 and 2020. We evaluated the effect of alternative camera configurations and durations of camera trapping on density estimates and used an N‐mixture model to estimate raccoon densities, including covariates on abundance and detection. We further compared different methods of scaling camera‐based counts, with the maximum number of raccoons seen on any given image within a day best explaining density. Camera‐trap density estimates were moderately correlated with CMR estimates ( r = 0.56). However, densities from camera‐trap data were more reliable when classifying category of density as an index used to inform management (83% correct when compared to CMR estimates), although the densities in our study fell into the 2 lowest density classes only. Using more cameras reduced bias and uncertainty around density estimates; however, if ≤6 camera traps were used at a site, a line transect approach proved less biased than a grid design. Camera trapping should be conducted for at least 3 weeks for more accurate estimates of raccoon population density in our study area (<5% bias). We show that camera‐trap data can be used to assign raccoon densities to management‐relevant density index bins, but more studies are needed to ensure reliability across a greater range of environmental conditions and raccoon densities.

Davis, Amy J.↗

On extending Kohn-Sham density functionals to systems with fractional number of electrons

Here, we analyze four ways of formulating the Kohn-Sham (KS) density functionals with a fractional number of electrons, through extending the constrained search space from the Kohn-Sham and the generalized Kohn-Sham (GKS) non-interacting $\mathcal{v}$-representable density domain for integer systems to four different sets of densities for fractional systems. In particular, these density sets are (I) ensemble interacting N -representable densities, (II) ensemble non-interacting N -representable densities, (III) non-interacting densities by the Janak construction, and (IV) non-interacting densities whose composing orbitals satisfy the Aufbau occupation principle. By proving the equivalence of the underlying first order reduced density matrices associated with these densities, we show that sets (I), (II), and (III) are equivalent, and all reduce to the Janak construction. Moreover, for functionals with the ensemble v-representable assumption at the minimizer, (III) reduces to (IV) and thus justifies the previous use of the Aufbau protocol within the (G)KS framework in the study of the ground state of fractional electron systems, as defined in the grand canonical ensemble at zero temperature. By further analyzing the Aufbau solution for different density functional approximations (DFAs) in the (G)KS scheme, we rigorously prove that there can be one and only one fractional occupation for the Hartree Fock functional, while there can be multiple fractional occupations for general DFAs in the presence of degeneracy. This has been confirmed by numerical calculations using the local density approximation as a representative of general DFAs. This work thus clarifies important issues on density functional theory calculations for fractional electron systems.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

What Sets the Star Formation Rate of Molecular Clouds? The Density Distribution as a Fingerprint of Compression and Expansion Rates

We use a suite of 3D simulations of star-forming molecular clouds, with and without stellar feedback, magnetic fields, and driven turbulence, to study the compression and expansion rates of the gas as functions of density. We show that, around the mean density, supersonic turbulence promotes rough equilibrium between the amounts of compressing and expanding gas, consistent with continuous gas cycling between high- and low-density states. We find that the inclusion of protostellar jets produces rapidly expanding and compressing low-density gas. We find that the gas mass flux peaks at the transition between the lognormal and power-law forms of the density probability distribution function (PDF). This is consistent with the transition density tracking the post-shock density, which promotes an enhancement of mass at this density (i.e., shock compression and filament formation). At high densities, the gas dynamics are dominated by self-gravity: the compression rate in all of our runs matches the rate of the run with only gravity, suggesting that processes other than self-gravity have little effect at these densities. The net gas mass flux becomes constant at a density below the sink formation threshold, where it equals the star formation rate. The density at which the net gas mass flux equals the star formation rate is one order of magnitude lower than our sink threshold density, corresponds to the formation of the second power-law tail in the density PDF, and sets the overall star formation rates of these simulations.

79 ASTRONOMY AND ASTROPHYSICS↗

The O(+) Density Trough at 5000 km Altitude in the Polar Cap

At altitudes near 5000 km over the southern polar cap region of the terrestrial magnetosphere/ionosphere, the Thermal Ion Dynamics Experiment (TIDE) on board the Polar satellite has observed O(+) ion density trough regions, in which the densities were at least one order of magnitude lower than the surrounding O(+) densities. In the 0" density trough regions, the estimated O+ densities were generally lower than 0.01 per cc. The boundaries between normal density level regions and the trough density regions were usually abrupt transitions. From 1 December 1997 to 30 November 1998, polar cap O(+) troughs in Polar/TIDE observations occurred at a frequency of about 48%. Statistical examination of the Polar perigee observations from 1 December 1997 to 30 November 1998 shows that the Polar perigee passes evenly covered the southern polar cap region, while the O(+) density trough was always located on the nightside portion of the polar cap magnetosphere/ionosphere, and that invariant latitude spans of such troughs could be as large as 23 deg. in extent. The trough occurrence displayed a strong seasonal dependence; in the winter season (e.g., for July in the Southern Hemisphere) the O(+) ion density trough occurrence frequency ranged up to 92%, while in the summer season (e.g., for January in the Southern Hemisphere) it decreased to as low as 15%. Our statistical results show that the trough occurrence was generally anticorrelated with solar wind dynamic pressure in the solar wind dynamic pressure range 0.8 - 2.6 nanopascal. The O(+) ion density trough occurrence appeared relatively independent of the geomagnetic Kp index, IMF Bz, and By conditions. However, as suggested by the seasonal dependence, the O(+) ion density trough occurrence was strongly related to the solar zenith angle (SZA). In the SZA range 50 deg. to 125 deg., the trough occurrence increased monotonically with SZA. In addition, we sought to determine consistent density and velocity signatures at lower altitudes associated the O(+) ion density trough at 5000 km by examining the near-simultaneous O(+) densities and vertical velocities observed by the DMSP satellite group orbiting at 840 km altitude. However, consistent correlations between the dual altitudes were not reliably established from the present examinations.

Zeng, W.↗

Meteoroid Bulk Density and Ceplecha Types

The determination of asteroid bulk density is an important aspect of Near Earth Object (NEO) characterization. A fraction of meteoroids originate from asteroids (including some NEOs), thus in lieu of mutual perturbations, satellites, or expensive spacecraft missions, a study of meteoroid bulk densities can potentially provide useful insights into the densities of NEOs and PHOs (Potentially Hazardous Objects). Meteoroid bulk density is still inherently difficult to measure, and is most often determined by modeling the ablation of the meteoroid. One approach towards determining a meteoroid density distribution entails using a more easily measured proxy for the densities, then calibrating the proxy with known densities from meteorite falls, ablation modelling, and other sources. An obvious proxy choice is the Ceplecha type, KB (Ceplecha, 1958), which is thought to indicate the strength of a meteoroid and often correlated to different bulk densities in literature. KB is calculated using the air density at the beginning height of the meteor, the initial velocity, and the zenith angle of the radiant; quantities more readily determined than meteoroid bulk density itself. Numerical values of K(sub B) are sorted into groups (A, B, C, etc.), which have been matched to meteorite falls or meteor showers with known composition such as the porous Draconids. An extensive survey was conducted to establish the strength of the relationship between bulk density and K(sub B), specifically looking at those that additionally determined K(sub B) for the meteors. In examining the modeling of high-resolution meteor data from Kikwaya et al. (2011), the correlation between K(sub B) and bulk density was not as strong as hoped. However, a distinct split by dynamical type was seen with Jovian Tisserand parameter (T(sub J)), with meteoroids from Halley Type comets (T(sub J) < 2) exhibiting much lower bulk densities than those originating from Jupiter Family comets and asteroids (T(sub J) > 2). Therefore, this work indicates that the dynamical classification of a meteoroid is a better indicator of the density than the strength proxy, a somewhat surprising result.

Blaauw, R. C.↗

Investigation of Small-Scale Electron Density Irregularities Observed by the Arase and Van Allen Probes Satellites Inside and Outside the Plasmasphere

In situ electron density profiles obtained from Arase in the night magnetic local time (MLT) sector and from RBSP-B covering all MLTs are used to study the small-scale density irregularities present in the plasmasphere and near the plasmapause. Electron density perturbations with amplitudes >10% from background density and with time-scales less than 30-min are investigated here as the small-scale density irregularities. The statistical survey of the density irregularities is carried out using nearly 2 years of density data obtained from RBSP-B and 4 months of data from Arase satellites. The results show that density irregularities are present globally at all MLT sectors and L-shells both inside and outside the plasmapause, with a higher occurrence at L > 4. The occurrence of density irregularities is found to be higher during disturbed geomagnetic and interplanetary conditions. The case studies presented here revealed: (1) The plasmaspheric density irregularities observed during both quiet and disturbed conditions are found to coexist with the hot plasma sheet population. (2) During quiet periods, the plasma waves in the whistler-mode frequency range are found to be modulated by the small-scale density irregularities, with density depletions coinciding well with the decrease in whistler intensity. Our observations suggest that different source mechanisms are responsible for the generation of density structures at different MLTs and geomagnetic conditions.

79 ASTRONOMY AND ASTROPHYSICS↗

The O+ Density Trough at 5000 km Altitude in the Polar Cap

At altitudes near 5000 km over the Southern polar cap region of the terrestrial magnetospherehonosphere, the Thermal Ion Dynamics Experiment (TIDE) onboard the Polar satellite has observed O+ ion density trough regions, in which the O+ densities were at least one order of magnitude lower than the surrounding O+ densities. In the O+ demify trough regions, the estimated O+ densities were generally lower than 0.01 per cc. The boundaries between normal density level regions and the trough density regions were usually abrupt transitions. From December 1, 1997 to November 30, 1998, polar cap O+ troughs in Polar/TIDE observations occurred at a frequency of about 48%. Statistical examination of the Polar perigee observations from December 1 , 1997 to November 30, 1998 shows that the Polar perigee passes evenly covered the southern polar cap region, while the O+ density trough was always located on the nightside portion of the polar cap magnetospherehonosphere, and that invariant latitude spans of such troughs could be as large as 230 in extent. The trough occurrence displayed strong seasonal dependence; in the winter season (e.g. for July in the southern hemisphere) the O+ ion density trough occurrence frequency ranged up to 92%, while in the summer season (e.g. for January in the southern hemisphere) it decreased to as infrequent as 15%. The O+ ion density trough occurrence appeared relatively independent of the geomagnetic Kp index, and IMF Bz, By conditions. However, as suggested by the seasonal dependence, the O+ ion density trough occurrence was strongly related to the solar zenith angle (SZA). In the SZA range 500 to 1250, the trough occurrence increased monotonically with SZA. Also, case-by-case examinations of near-simultaneous O+ densities and vertical velocities observed by the DMSP satellite group orbiting at 840 km altitude indicate that the O+ density troughs observed at 5000 km altitude exhibit moderate correlation or anti-correlation with topside ionosphere density or velocity features at 840 km altitude for approximately half of the near-conjunction cases examined.

Zeng, W.↗