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Electrochemical Modeling of Iodide Oxidation in Metal-Halide Molten Salts

The oxidation of iodide in NaI-AlBr 3 , NaI-AlCl 3 , and NaI-GaCl 3 molten salts was analyzed using simulation software to extract relevant kinetic parameters. The experimental oxidation potentials were ordered AlCl 3 < AlBr 3 < GaCl 3 , with higher oxidation potentials correlating with softer Lewis acidity of the metal halide. An iodide oxidation and metal halide speciation model was developed and simulated to fit the electrochemical response, enabling determination of electrochemical charge transfer parameters and chemical equilibrium constants. NaI-AlBr 3 displayed the fastest electron transfer rates yet showed the lowest current densities. All salts revealed smaller than expected current densities, explained by equilibrium between various species, where some are not electrochemically active at the studied potentials. These equilibrium reactions are due to the various metal halide species, controlling the reactant concentration of iodide and the resultant current. We hypothesize the electrochemically active iodide species, present as a metal halide monomer (MX 3 I − ), is decreased dramatically from the expected concentration, sequestered as a more stable metal halide dimer species (M 2 X 6 I − ) with a higher oxidation potential. Traditional Tafel analysis of the experimental data supports the validity of the simulations. These results increase understanding of iodide oxidation in low-temperature Lewis acidic molten salts and inform task-specific molten salt design.

Lee, Rose Y. (ORCID:0000000226587220)↗

The Response of the BATSE LADs to Radiation From the Crab Nebula and Plans for Radioactivity Studies on Space Station

The Burst And Transient Source Experiment (BATSE) onboard the Compton Gamma-Ray Observatory (CGRO) was designed to measure X-rays and gamma rays with energies from about 50 keV to above 2 MeV. As with many scientific investigations, the success of the original experiment lead to additional areas of research interest. In the case of BATSE the ability to observe the radiation from sources down to about 20 keV became readily apparent. This lead to a continuing program of measuring the spectrum of radiation from stellar objects at these lower energies. One of these, the Crab Nebula, has a very steady radiation flux and, thus, has become a "standard candle" for such measurements. The Large Area Detectors (LADS) on BATSE contain a 1.27-cm thick, 25.4-cm radius NaI(Tl) detector behind a 6.35-mm thick polystyrene Charged Particle Detector (CPD) used to "veto" charged particles signals. The detectors have been calibrated with a series of gamma and X-ray sources and the results carefully simulated with a Monte Carlo code. In the calibration process the computer simulation accounts for scattering from material in the counting room as well as the BATSE structure. For an orbiting detector, scattering from the entire spacecraft must be modeled as well as for all covering material over the detectors. Five years after CGRO was launched on April 5, 1991, a large body of observational data has been taken of the Crab Nebula. The technique used for these observations, and for many other X-ray sources, is Earth occultation. From the perspective of the spacecraft, the Earth occults most stellar objects once in orbit, i.e., the signal is lost as the source sets and is regained as the source rises. A careful analysis of the continuing signals from all sources measured allows for an accurate measurement of the spectrum of a given source. An analysis of this data from the Crab has indicated that the LADs are very responsive at energies as low as 20 keV-at energies below the range of calibration. While the model accounts for many of the interactions of the photons with the detectors, the observation of nonstatistical deviations at low energy and at small angles has suggested a need to recalibrate at energies where the attenuation effects are increasing exponentially.

Laird, C. E.↗

Gate-tunable heavy fermion quantum criticality in a moiré Kondo lattice

We propose a realization of Kondo lattice physics in moiré superlattices at the interface between a WX 2 homobilayer and MoX 2 monolayer (X = S,Se). Under appropriate gating conditions, the interface WX 2 layer forms a triangular lattice of local moments that couple to itinerant electrons in the other WX 2 layer via a gate-tunable Kondo exchange interaction. Using a parton mean-field approach, we identify a range of twist angles which support a gate-tuned quantum phase transition between a heavy Fermi liquid with large anomalous Hall conductance and a chiral spin liquid coexisting with a light Fermi liquid and describe experimental signatures to distinguish among competing theoretical scenarios.

36 MATERIALS SCIENCE↗

Satellite-Surface Perspectives of Air Quality and Aerosol-Cloud Effects on the Environment: An Overview of 7-SEAS BASELInE

The objectives of 7-SEASBASELInE (Seven SouthEast Asian Studies Biomass-burning Aerosols and Stratocumulus Environment: Lifecycles and Interactions Experiment) campaigns in spring 2013-2015 were to synergize measurements from uniquely distributed ground-based networks (e.g., AERONET (AErosol RObotic NETwork)), MPLNET ( NASA Micro-Pulse Lidar Network)) and sophisticated platforms (e.g.,SMARTLabs (Surface-based Mobile Atmospheric Research and Testbed Laboratories), regional contributing instruments), along with satellite observations retrievals and regional atmospheric transport chemical models to establish a critically needed database, and to advance our understanding of biomass-burning aerosols and trace gases in Southeast Asia (SEA). We present a satellite-surface perspective of 7-SEASBASELInE and highlight scientific findings concerning: (1) regional meteorology of moisture fields conducive to the production and maintenance of low-level stratiform clouds over land; (2) atmospheric composition in a biomass-burning environment, particularly tracers-markers to serve as important indicators for assessing the state and evolution of atmospheric constituents; (3) applications of remote sensing to air quality and impact on radiative energetics, examining the effect of diurnal variability of boundary-layer height on aerosol loading; (4) aerosol hygroscopicity and ground-based cloud radar measurements in aerosol-cloud processes by advanced cloud ensemble models; and (5) implications of air quality, in terms of toxicity of nanoparticles and trace gases, to human health. This volume is the third 7-SEAS special issue (after Atmospheric Research, vol. 122, 2013; and Atmospheric Environment, vol. 78, 2013) and includes 27 papers published, with emphasis on air quality and aerosol-cloud effects on the environment. BASELInE observations of stratiform clouds over SEA are unique, such clouds are embedded in a heavy aerosol-laden environment and feature characteristically greater stability over land than over ocean, with minimal radar surface clutter at a high vertical spatial resolution. To facilitate an improved understanding of regional aerosol-cloud effects, we envision that future BASELInE-like measurement modeling needs fall into two categories: (1) efficient yet critical in-situ profiling of the boundary layer for validating remote-sensing retrievals and for initializing regional transport chemical and cloud ensemble models; and (2) fully utilizing the high observing frequencies of geostationary satellites for resolving the diurnal cycle of the boundary layerheight as it affects the loading of biomass-burning aerosols, air quality and radiative energetics.

AERONET↗

Global Long-Term SeaWiFS Deep Blue Aerosol Products available at NASA GES DISC

Long-term climate data records about aerosols are needed in order to improve understanding of air quality, radiative forcing, and for many other applications. The Sea-viewing Wide Field-of-view Sensor (SeaWiFS) provides a global well-calibrated 13- year (1997-2010) record of top-of-atmosphere radiance, suitable for use in retrieval of atmospheric aerosol optical depth (AOD). Recently, global aerosol products derived from SeaWiFS with Deep Blue algorithm (SWDB) have become available for the entire mission, as part of the NASA Making Earth Science data records for Use in Research for Earth Science (MEaSUREs) program. The latest Deep Blue algorithm retrieves aerosol properties not only over bright desert surfaces, but also vegetated surfaces, oceans, and inland water bodies. Comparisons with AERONET observations have shown that the data are suitable for quantitative scientific use [1],[2]. The resolution of Level 2 pixels is 13.5x13.5 km2 at the center of the swath. Level 3 daily and monthly data are composed by using best quality level 2 pixels at resolution of both 0.5ox0.5o and 1.0ox1.0o. Focusing on the southwest Asia region, this presentation shows seasonal variations of AOD, and the result of comparisons of 5-years (2003- 2007) of AOD from SWDB (Version 3) and MODIS Aqua (Version 5.1) for Dark Target (MYD-DT) and Deep Blue (MYD-DB) algorithms.

Shen, Suhung↗

Analysis of unsteady pressures induced on a body by a rotor

An analysis was conducted on the unsteady pressures measured on a body surface in proximity to a rotor. Unsteady pressures were measured at strategic points on the body in forward flight at various combination of advance ratio, rotor thrust, and tip-path-plane angle. It was found that the local values of unsteady pressure were significantly altered by small changes in rotor thrust and advance ratio; tip-path-plane angle variations had a much smaller effect. Four characteristic pressure signatures representative of (1) blade passage, (2) close wake interactions with the body, (3) wake impingement on the body, and (4) postwake impingement were distinguished. These classifications were supported by correlations with shadowgraphic flow visualization of the rotor wake/body interaction, as well as unsteady potential flow models. This general classification of the surface pressure signatures has permitted a greater physical understanding of the overall air loads and possible mechanisms responsible for the interactional effects between a helicopter rotor and its fuselage.

Bi, Nai-Pei↗

Results from a Si(Li) gamma ray detector stack for future Mars missions

We present Monte Carlo analysis and experimental data from a novel lithium-drifted silicon detector stack for gamma ray spectroscopy instrumentation in future Mars surface landers and other planetary missions. The Monte Carlo analysis shows full energy photopeaks even in the range of about 100 keV to 2 MeV where, in Si, Compton scattering dominates the absorption processes. Laboratory data is shown for an experimental detector stack of four planar Si(Li) devices, each 5 mm thick with an active area 2 cm in diameter. All the experimental data were collected with maximum temperature of the stack at 175 K. Background reduction is achieved by using the detector of the stack closest to the source in anticoincidence. We present a comparison of experimental data from the stack with the Monte Carlo model for Cs-137 (662 keV). Agreement is shown to be good, with a full energy photopeak clearly seen (FWHM about 10 keV). Experimental stack data is also shown for multiple peaks at 511 keV (Na-22) and 662 keV (Cs-137). The peaks are clearly resolved (FWHM 10 keV), and are compared with the results obtained using a 8 percent resolution, 3 in. x 3 in. NaI(TI) device (FWHM about 50 keV).

Hubbard, G. S.↗

A novel experimental system for the KDK measurement of the 40 K decay scheme relevant for rare event searches

Potassium-40 ( 40 K) is a long-lived, naturally occurring radioactive isotope. The decay products are prominent backgrounds for many rare event searches, including those involving NaI-based scintillators. 40 K also plays a role in geochronological dating techniques. The branching ratio of the electron capture directly to the ground state of argon-40 has never been measured, which can cause difficulty in interpretingcertain results or can lead to lack of precision depending on the field and analysis technique. Additionally, the KDK (Potassium (K) Decay (DK)) collaboration is measuring this decay. A composite method has a silicon drift detector with an enriched, thermally deposited 40 K source inside the Modular Total Absorption Spectrometer. This setup has been characterized in terms of energy calibration, gamma tagging efficiency, live time and false negatives and positives. A complementary, homogeneous, method is also discussed; it employs a KSr 2 I 5 :Eu scintillator as source and detector.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

High mobility in a van der Waals layered antiferromagnetic metal

Van der Waals (vdW) materials with magnetic order have been heavily pursued for fundamental physics as well as for device design. Despite the rapid advances, so far, they are mainly insulating or semiconducting, and none of them has a high electronic mobility—a property that is rare in layered vdW materials in general. The realization of a high-mobility vdW material that also exhibits magnetic order would open the possibility for novel magnetic twistronic or spintronic devices. Here, we report very high carrier mobility in the layered vdW antiferromagnet GdTe 3 . The electron mobility is beyond 60,000 cm 2 V –1 s –1 , which is the highest among all known layered magnetic materials, to the best of our knowledge. Among all known vdW materials, the mobility of bulk GdTe 3 is comparable to that of black phosphorus. By mechanical exfoliation, we further demonstrate that GdTe 3 can be exfoliated to ultrathin flakes of three monolayers.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

HyKKT: a hybrid direct-iterative method for solving KKT linear systems

Here, we propose a solution strategy for the large indefinite linear systems arising in interior methods for nonlinear optimization. The method is suitable for implementation on hardware accelerators such as graphical processing units (GPUs). The current gold standard for sparse indefinite systems is the LBLT factorization where L is a lower triangular matrix and B is 1×1 or 2×2 block diagonal. However, this requires pivoting, which substantially increases communication cost and degrades performance on GPUs. Our approach solves a large indefinite system by solving multiple smaller positive definite systems, using an iterative solver on the Schur complement and an inner direct solve (via Cholesky factorization) within each iteration. Cholesky is stable without pivoting, thereby reducing communication and allowing reuse of the symbolic factorization. We demonstrate the practicality of our approach on large optimal power flow problems and show that it can efficiently utilize GPUs and outperform LBL T factorization of the full system.

97 MATHEMATICS AND COMPUTING↗

Astrobiology Sample Analysis Program (ASAP) for Advanced Life Detection Instrumentation Development and Calibration

Scientific ground-truth measurements for near-term Mars missions, such as the 2009 Mars Science Laboratory (MSL) mission, are essential for validating current in situ flight instrumentation and for the development of advanced instrumentation technologies for life-detection missions over the next decade. The NASA Astrobiology Institute (NAI) has recently funded a consortium of researchers called the Astrobiology Sample Analysis Program (ASAP) to analyze an identical set of homogenized martian analog materials in a "round-robin" style using both state-of-the-art laboratory techniques as well as in-situ flight instrumentation including the SAM gas chromatograph mass spectrometer and CHEMIN X-ray diffraction/fluorescence instruments on MSL and the Urey and MOMA organic analyzer instruments under development for the 2013 ExoMars missions. The analog samples studied included an Atacama Desert soil from Chile, the Murchison meteorite, a gypsum sample from the 2007 AMASE Mars analog site, jarosite from Panoche Valley, CA, a hydrothermal sample from Rio Tinto, Spain, and a "blind" sample collected during the 2007 MSL slow-motion field test in New Mexico. Each sample was distributed to the team for analysis to: (1) determine the nature and inventory of organic compounds, (2) measure the bulk carbon and nitrogen isotopic composition, (3) investigate elemental abundances, mineralogy and matrix, and (4) search for biological activity. The experimental results obtained from the ASAP Mars analog research consortium will be used to build a framework for understanding the biogeochemistry of martian analogs, help calibrate current spaceflight instrumentation, and enhance the scientific return from upcoming missions.

Glavin, Daniel↗

Precise Measurements of the Density and Critical Phenomena Near Phase Transitions in Liquid Helium

The first-year progress for the project of precise measurements of the density and critical phenomena of helium near phase transitions is summarized below: (1) completion of a cryogenic sample probe for the proposed measurements, and the rehabilitation of a designated laboratory at Caltech for this project; (2) construction and testing of a superconducting niobium cavity; (3) acquisition of one phase-locked-loop system for high-resolution frequency control and read- out; (4) setting up high-resolution thermometry (HRT) for temperature readout and control; (5) developing new approaches for calibrating the coefficient between the resonant frequency shift (delta f) and the helium density (rho), as well as for measuring the effect of gravity on T(sub lambda) to a much better precision; (6) programming of the interface control of all instruments for automatic data acquisition; and (7) improving data analyses and fitting procedures.

Yeh, Nai-Chang↗

A theoretical overview of isospin and EOS effects in heavy-ion reactions at intermediate energies

The isospin dependence of in-medium nuclear effective interactions is a fundamental issue in nuclear physics and has broad ramifications in astrophysics. Its uncertainties, especially the difference of neutron-proton interactions in the isosinglet and isotriplet channels, affect significantly the density and momentum dependence of the isovector single-nucleon potential and nucleon-nucleon short-range correlation in neutron-rich matter. Consequently, the neutron-proton effective mass splitting and the density dependence of nuclear symmetry energy are still rather uncertain. Heavy-ion reactions, especially those involving rare isotopes, are a useful tool for probing the isospin dependence of nuclear effective interactions through 1) the neutron-skin in coordinate and proton-skin in momentum of the initial state of colliding nuclei, 2) the density and momentum dependence of especially the isovector nuclear mean-field as well as 3) the isospin dependence of in-medium nucleon-nucleon cross sections. Observations of neutron stars especially since GW1710817 have also helped us significantly in understanding the isospin dependence of nuclear effective interactions. We summarize here a review talk on these issues given at the 2021 International Workshop on multi-facets of EOS and Clustering. For details we refer the readers to the original publications and references therein.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

The non-centrosymmetric layered compounds IrTe 2 I and RhTe 2 I

The previously unreported layered compounds IrTe 2 I and RhTe 2 I were prepared by a high-pressure synthesis method. Single crystal X-ray and powder X-ray diffraction studies find that the compounds are isostructural, crystallizing in a layered orthorhombic structure in the non-centrosymmetric, non-symmorphic space group Pca2 1 (#29). Characterization reveals diamagnetic, high resistivity, semiconducting behavior for both compounds, consistent with the +3 chemical valence and d 6 electronic configurations for both iridium and rhodium and the Te–Te dimers seen in the structural study. Finally, electronic band structures are calculated for both compounds, showing good agreement with the experimental results.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Epitopes recognition of SARS-CoV-2 nucleocapsid RNA binding domain by human monoclonal antibodies

Coronavirus nucleocapsid protein (NP) of SARS-CoV-2 plays a central role in many functions important for virus proliferation including packaging and protecting genomic RNA. The protein shares sequence, structure, and architecture with nucleocapsid proteins from betacoronaviruses. The N-terminal domain (NP RBD ) binds RNA and the C-terminal domain is responsible for dimerization. After infection, NP is highly expressed and triggers robust host immune response. The anti-NP antibodies are not protective and not neutralizing but can effectively detect viral proliferation soon after infection. Two structures of SARS-CoV-2 NP RBD were determined providing a continuous model from residue 48 to 173, including RNA binding region and key epitopes. Five structures of NP RBD complexes with human mAbs were isolated using an antigen-bait sorting. Complexes revealed a distinct complement-determining regions and unique sets of epitope recognition. This may assist in the early detection of pathogens and designing peptide-based vaccines. Mutations that significantly increase viral load were mapped on developed, full length NP model, likely impacting interactions with host proteins and viral RNA.

59 BASIC BIOLOGICAL SCIENCES↗

Extreme Lake-Effect Snow from a GPM Microwave Imager Perspective: Observational Analysis and Precipitation Retrieval Evaluation

This study focuses on the ability of the Global Precipitation Measurement (GPM) passive microwave sensors to detect and provide quantitative precipitation estimates (QPE) for extreme lake-effect snowfall events over the United States lower Great Lakes region. GPM Microwave Imager (GMI) high frequency channels can clearly detect intense shallow convective snowfall events. However, GMI Goddard PROfiling (GPROF) QPE retrievals produce inconsistent results when compared against the Multi-Radar/Multi-Sensor (MRMS) ground-based radar reference dataset. While GPROF retrievals adequately capture intense snowfall rates and spatial patterns of one event, GPROF systematically underestimates intense snowfall rates in another event. Furthermore, GPROF produces abundant light snowfall rates that do not conform with MRMS observations. Ad-hoc precipitation rate thresholds are suggested to partially mitigate GPROF’s overproduction of light snowfall rates. The sensitivity and retrieval efficiency of GPROF to key parameters (2-meter temperature, total precipitable water, and background surface type) used to constrain the GPROF a-priori retrieval database are investigated. Results demonstrate that typical lake-effect snow environmental and surface conditions, especially coastal surfaces, are underpopulated in the database and adversely affect GPROF retrievals. For the two presented case studies, using snow cover a-priori database in the locations of originally deemed as coastline improves retrieval. This study suggests that it is particularly important to have more accurate GPROF surface classifications and better representativeness of the a-priori databases to improve intense lake-effect snow detection and retrieval performance.

Lisa Milani↗

Impact of symmetry energy on sound speed and spinodal decomposition in dense neutron-rich matter

Using a meta model for nuclear Equation of State (EOS) with its parameters constrained by astrophysical observations and terrestrial nuclear experiments, we examine effects of nuclear EOS especially its symmetry energy $E$ sym ($ρ$) term on the speed of sound squared $C$ $^2_s$($ρ$) and the critical density ρt where $C$ $^2_s$($ρ_t$) vanishes (indicating the onset of spinodal decomposition) in both dense neutron-rich nucleonic matter relevant for relativistic heavy-ion collisions and the cold $n$ + $p$ + $e$ + $μ$ matter in neutron stars at $β$- equilibrium. Unlike in nucleonic matter with fixed values of the isospin asymmetry $δ$, in neutron stars with a density dependent isospin profile $δ$($ρ$) determined consistently by the $β$-equilibrium and charge neutrality conditions, the $C$ $^2_s$($ρ$) almost always show a peak and then vanishes at $ρ_t$. Furthermore, the latter strongly depends on the high-density behavior of $E$ sym ($ρ$) if the skewness parameter $J$ 0 characterizing the stiffness of high-density symmetric nuclear matter (SNM) EOS is not too far above its currently known most probable value of about -190 MeV inferred from recent Bayesian analyses of neutron star observables. Moreover, in the case of having a super-soft $E$ sym ($ρ$) that is decreasing with increasing density above about twice the saturation density of nuclear matter, the $ρ$ $t$ is significantly lower than the density where the $E$ sym ($ρ$) vanishes (indicating the onset of isospin-separation instability and pure neutron matter formation) in neutron star cores.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Aerosol Optical Properties at the Lulin Atmospheric Background Station in Taiwan and the Influences of Long-Range Transport of Air Pollutants

The Lulin Atmospheric Background Station (LABS, 23.47 deg. N 120.87 deg. E, 2862 m ASL) in Central Taiwan was constructed in 2006 and is the only high-altitude background station in the western Pacific region for studying the influence of continental outflow. In this study, extensive optical properties of aerosols, including the aerosol light scattering coefficient [Sigma(sub s)] and light absorption coefficient [Sigma(sub a)], were collected from 2013 to 2014. The intensive optical properties, including mass scattering efficiency [Sigma(sub s)], mass absorption efficiency [Sigma(sub a)] single scattering albedo (Omega), scattering Angstrom exponent (A), and backscattering fraction (b), were determined and investigated, and the distinct seasonal cycle was observed. The value of [Alpha(sub a)] began to increase in January and reached a maximum in April; the mean in spring was 5.89 m(exp. 2) g(exp. -1) with a standard deviation (SD) of 4.54 m(exp. 2) g(exp. -1) and a 4.48 m(exp. 2) g(exp. -1) interquartile range (IQR: 2.95-7.43 m(exp. 2) g(exp. -1). The trend was similar in [Sigma(sub a)], with a maximum in March and a monthly mean of 0.84 m(exp. 2) g(exp. -1). The peak values of Omega (Mean = 0.92, SD = 0.03, IQR: 0.90 - 0.93) and A (Mean = 2.22, SD = 0.61, IQR: 2.12 = 2.47) occurred in autumn. These annual patterns of optical properties were associated with different long-range transport patterns of air pollutants such as biomass burning (BB) aerosol in spring and potential anthropogenic emissions in autumn. The optical measurements performed at LABS during spring in 2013 were compared with those simultaneously performed at the Doi Ang Kang Meteorology Station, Chiang Mai Province, Thailand (DAK, 19.93 deg. N, 99.05 deg. E, 1536 m a.s.l.), which is located in the Southeast Asia BB source region. Furthermore, the relationships among [Sigma(sub s)], [Sigma(sub a)], and (b) were used to characterize the potential aerosol types transported to LABS during different seasons, and the data were inspected according to the HYSPLIT 5-day backward trajectories, which differentiate between different regions of air mass origin.

aerosol optical properties↗