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DOE OSTI2020

Correlations between triaxial shapes and formation history of dark matter haloes

ABSTRACT The shape of dark matter (DM) haloes plays a critical role in constraining cosmology with upcoming large-scale structure surveys. In this paper, we study the correlations between the triaxial shapes and formation histories in DM haloes in the MultiDark Planck 2 N-body cosmological simulation. We find that halo ellipticity is strongly correlated with halo properties that serve as proxies of halo formation history, such as halo concentration and the normalized peak-centroid offset. These correlations are nearly independent of the halo density peak height. We present a simple model for the correlation between halo ellipticity and concentration using conditional abundance matching, and provide fitting formulae for the multidimensional distributions of triaxial halo shape as a function of halo peak height. We apply our halo shape model to gauge the effects of halo ellipticity and orientation bias on the excess surface mass density profiles in cluster-sized haloes. Our model should be useful for exploring the impact of triaxial halo shape on cosmological constraints in upcoming weak lensing surveys of galaxy clusters.

79 ASTRONOMY AND ASTROPHYSICS↗

DOE OSTI2022

First-principles wave-vector- and frequency-dependent exchange-correlation kernel for jellium at all densities

Here we propose a spatially and temporally nonlocal exchange correlation (XC) kernel for the spin-unpolarized fluid phase of ground-state jellium for use in time-dependent density functional and linear response calculations. The kernel is constructed to satisfy known properties of the exact XC kernel to accurately describe the correlation energies of bulk jellium and to satisfy frequency-moment sum rules at a wide range of bulk jellium densities, including those low densities that display strong correlation and symmetry breaking. These effects are easier to understand in the simple jellium model than in real systems. All exact constraints satisfied by the recent MCP07 kernel are maintained in the revised MCP07 (rMCP07) kernel, while others are added. The revision $f^{rMCP07}_{XC}$ (q, ω) differs from MCP07 only for nonzero frequencies ω. Only at densities much lower than those of real bulk metals is the frequency dependence of the kernel important for the correlation energy of jellium. As the wave vector q tends to zero, the kernel has a -4$πα(ω)/q^2$ divergence whose frequency-dependent ultranonlocality coefficient $α(ω)$ vanishes in jellium, and is predicted by rMCP07 to be extremely small for the real metals Al and Na.

36 MATERIALS SCIENCE↗

NASA NTRS1990

The inter-outburst behavior of cataclysmic variables

Existing International Ultraviolet Explorer (IUE) and American Association of Variable Star Observers (AAVSO) archive data was used to accomplish a large scale study of what happens to the ultraviolet flux of accretion disk systems during the quiescent intervals between outbursts and how it relates to the preceding outburst characteristics of amplitude and width. The data sample involved multiple IUE observations for 16 dwarf novae and 8 novae along with existing optical coverage. Results indicate that most systems show correlated ultraviolet (UV) flux behavior with interoutburst phase, with 60 percent of the dwarf novae and 50 percent of the novae having decreasing flux trends while 33 percent of the dwarf novae and 38 percent of the novae show rising UV flux during the quiescent interval. All of the dwarf novae with decreasing UV fluxes at 1475A have orbital periods longer than 4.4 hours, while all (except BV Cen) with flat or rising fluxes at 1475A have orbital periods less than two hours. There are not widespread correlations of the UV fluxes with the amplitude of the preceding outburst and no correlations with the width of the outburst. From a small sample (7) that have relatively large quiescent V magnitude changes between the IUE observations, most show a strong correlation between the UV and optical continuum. Interpretation of the results is complicated by not being able to determine how much the white dwarf contributes to the ultraviolet flux. However, it is now evident that noticeable changes are occurring in the hot zones in accreting systems long after the outburst, and not only for systems that are dominated by the white dwarf. Whether these differences are due to different outburst mechanisms or to changes on white dwarfs which provide varying contributions to the UV flux remains to be determined.

Szkody, Paula↗

DOE OSTI2023

Nuclear Criticality Safety Integral Experiment Covariance Determination

Integral benchmarks for criticality safety and nuclear data validation require expensive uncertainty quantification studies. Commonly, the uncertainty quantification ignores correlations between experiments that share components. Experiments such as the TEX (Thermal/Epithermal eXperiments) campaigns consist of many shared parts between experiments, such as fuel, which creates a strong correlation in their errors. While these correlations are known to exist, they are often not estimated due to the complexity of such calculations. This paper describes a software package that uses an intuitive method of determining the covariance for each of the experimental components, providing a correlation matrix for each family of parts across the multiple cases examined within a benchmark. The code uses the TEX-HEU campaign as a proof of concept, and we show that the correlations can be calculated with information commonly found in ICSBEP (International Criticality Safety Benchmark Evaluation Project) benchmarks. The estimated covariances are used in χ 2 trending studies to evaluate their impact on nuclear data validation. The covariance determination code can be easily integrated into current benchmark evaluations as well as reevaluating legacy benchmark uncertainties. Uncertainty correlation calculations should become the baseline for criticality safety integral experiment benchmarks and can now be easily calculated with the described software package.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

DOE OSTI2026

Frieze charge-stripes in a correlated kagome superconductor

In kagome metals, geometric frustration, electronic correlations and band topology combine to produce a wide range of intriguing phenomena. Among them, CsCr$_3$Sb$_5$ offers an opportunity to investigate unconventional superconductivity in a strongly correlated kagome system, with indications of frustrated magnetism and quantum criticality. Here, we demonstrate a cascade of density-wave transitions with distinct symmetries in bulk single crystals of CsCr$_3$Sb$_5$. Using spectroscopic imaging scanning tunneling microscopy, we uncover a unidirectional density wave that breaks all mirror symmetries -- resembling a chiral density wave -- but that also retains a mirror glide symmetry. We refer to this as a frieze charge stripe order phase, as its symmetry properties correspond to one of the fundamental frieze symmetry groups. A combination of high-resolution imaging, Fourier analysis and theoretical simulations reveal the key role of sublattice degrees of freedom in stabilizing this phase, characterized by internal chiral textures of opposite handedness. These findings suggest that superconductivity in CsCr$_3$Sb$_5$ emerges from this distinct density wave state and provide fresh insight into realizing electronic phases governed by frieze symmetry groups in quantum materials.

Cheng, Siyu [Boston College, Chestnut Hill, MA (Un↗

NASA NTRS1973

Correlations among the parameters of the spherical model for eclipsing binaries.

Correlation coefficients have been computed to investigate the parameters used to describe the spherical model of an eclipsing binary system. Regions in parameter hyperspace have been identified where strong correlations exist and, by implication, the solution determinacy is low. The results are presented in tabular form for a large number of system configurations.

Sobieski, S.↗

NASA NTRS1977

The galactic distribution (in radius and Z) of interstellar molecular hydrogen

Observations of the galactic longitude and latitude distributions of lambda = 2.6 mm CO emission are presented. Analysis of these spectral-line data yields the large-scale distribution of molecular clouds in the galactic disk and their z-distribution out of the disk. Strong maxima in the number of molecular clouds occur in the galactic nucleus and at galactic radii 4 to 8 kpc. The peak at 4 to 8 kpc correlates well with a region of enhanced 100-MeV gamma-ray emissivity. This correlation strongly supports the conclusion that the gamma-rays are produced as a result of cosmic ray interactions in molecular H2 clouds rather than in H(I). The width of the cloud layer perpendicular to the galactic plane between half-density points is 105 plus or minus 15 pc near the 5.5-kpc peak. The total mass of molecular gas in the interior of the galaxy exceeds that of atomic hydrogen and is 30 to the 9th power solar mass based on these observations.

Scoville, N. Z.↗

NASA NTRS1977

X-ray clusters of galaxies - Correlation of X-ray luminosity with galactic content

All 14 X-ray clusters of galaxies detected by the Ariel 5 satellite at high galactic latitudes with redshifts of less than 0.05 are analyzed optically for galaxy content. A strong correlation is found between cluster X-ray luminosity and galaxy type: the fraction of spiral galaxies in a cluster decreases rapidly with increasing X-ray luminosity. The observed correlation is consistent with a combined model of thermal bremsstrahlung emission from a hot intracluster gas and stripping of the spiral galaxies caused by the ram pressure of the same intracluster gas.

Bahcall, N. A.↗

NASA NTRS1983

Solar wind deceleration and MHD turbulence in the earth's foreshock region - ISEE 1 and 2 and IMP 8 observations

The interaction of the solar wind with ions backstreaming from the earth's bow shock is investigated using plasma and magnetic field measurements on ISEE 1 and 2 and IMP 8 at widely separated positions in the earth's foreshock. This technique separates temporal and spatial variations within the foreshock. It is found that the solar wind acceleration associated with backstreaming ions is correlated with the amplitude of the MHD turbulence, and that the largest decelerations are seen close to the bow shock. The density of the backstreaming ion beam is strongly correlated with distance from the shock, and decreases by about a factor of three in a distance of about 3R(e).

Bonifazi, C.↗

NASA NTRS1984

Ultraviolet spectral morphology of the O stars - The remarkable luminosity dependence of the Si IV stellar wind effect

An extensive survey of ultraviolet O type spectra, by means of high-resolution data from the International Ultraviolet Explorer archives, shows a strong correlation between both the photospheric and stellar wind features, and the optical spectral types. In particular, the stellar wind effect in the Si IV resonance doublet displays a strong luminosity dependence which has not been completely described before: there is no effect anywhere on the main sequence, but it develops gradually through the intermediate luminosity classes into a full P Cygni profile in the supergiants. This behavior is in sharp contrast to that of the C IV and N V, which have strong P Cygni profiles throughout most of the O type domain, including the main sequence. The Si IV effect simultaneously provides a sensitive classification criterion and poses an outstanding problem for detailed astrophysical interpretation. In addition, a new emission feature at 1574 A, possibly due to N III or to N IV forbidden line, is reported.

Walborn, N. R.↗

NASA NTRS1993

Maximum-likelihood analysis of the COBE angular correlation function

We have used maximum-likelihood estimation to determine the quadrupole amplitude Q(sub rms-PS) and the spectral index n of the density fluctuation power spectrum at recombination from the COBE DMR data. We find a strong correlation between the two parameters of the form Q(sub rms-PS) = (15.7 +/- 2.6) exp (0.46(1 - n)) microK for fixed n. Our result is slightly smaller than and has a smaller statistical uncertainty than the 1992 estimate of Smoot et al.

Seljak, Uros↗

DOE OSTI2021

Scale-dependent spatial variabilities of hydrological exchange flows and transit time in a large regulated river

Hydrological exchange flows (HEF) across the river-aquifer interface and the associated residence time of river water in the aquifer have important implications for contaminant plume migration and biogeochemical processes in the river corridor. HEFs and residence time are influenced by both subsurface physical features and hydrologic forcing related to the transport process, which can exhibit complex spatial and temporal variations. In this study, we used a massively parallel subsurface flow model and a particle-tracking model to study the influences of different control factors on spatial variability of HEFs and residence time distributions (RTD) in the Hanford Reach of the Columbia River in Washington State. A total number of 100M particles were randomly injected in time and space and then tracked in a model domain that covers a 51-km 2 area (15.1M model cells). We used hourly river stages and groundwater levels to drive the model to provide dynamic velocity fields for the particle tracking in the simulation period that was longer than 2 years. The groundwater flow simulation and particle-tracking results provide the first comprehensive assessment of the spatial distribution of HEFs and residence time in large complex river corridors. Overall, our results show that the aquifer hydrogeological structure has the strongest correlation with the extent and magnitude of exchange flux. The residence time exhibits complex patterns that are impacted by all the river geomorphologic, hydrodynamic, and hydrogeologic factors and are strongly correlated with the downwelling ratio of exchange flux. The new insights gained through this study can be used to support the development of reduced-order models of HEFs and RTDs for large complex river systems.

54 ENVIRONMENTAL SCIENCES↗

DOE OSTI2022

The chemical composition of globular clusters in the Local Group

We present detailed chemical abundance measurements for 45 globular clusters (GCs) associated with galaxies in (and, in one case, beyond) the Local Group. The measurements are based on new high-resolution integrated-light spectra of GCs in the galaxies NGC 185, NGC 205, M 31, M 33, and NGC 2403, combined with reanalysis of previously published observations of GCs in the Fornax dSph, WLM, NGC 147, NGC 6822, and the Milky Way. The GCs cover the range -2.8 < [Fe/H] < -0.1 and we determined abundances for Fe, Na, Mg, Si, Ca, Sc, Ti, Cr, Mn, Ni, Cu, Zn, Zr, Ba, and Eu. Corrections for non local thermodynamic equilibrium effects are included for Na, Mg, Ca, Ti, Mn, Fe, Ni, and Ba, building on a recently developed procedure. For several of the galaxies, our measurements provide the first quantitative constraints on the detailed composition of their metal-poor stellar populations. Overall, the GCs in different galaxies exhibit remarkably uniform abundance patterns of the α, iron-peak, and neutron-capture elements, with a dispersion of less than 0.1 dex in [α/Fe] for the full sample. There is a hint that GCs in dwarf galaxies are slightly less α-enhanced (by ~0.04 dex on average) than those in larger galaxies. One GC in M 33 (HM33-B) resembles the most metal-rich GCs in the Fornax dSph (Fornax 4) and NGC 6822 (SC7) by having α-element abundances closer to scaled-solar values, possibly hinting at an accretion origin. A principal components analysis shows that the α-element abundances strongly correlate with those of Na, Sc, Ni, and Zn. Several GCs with [Fe/H] < -1.5 are deficient in Mg compared to other α-elements. We find no GCs with strongly enhanced r-process abundances as reported for metal-poor stars in some ultra-faint dwarfs and the Magellanic Clouds. The similarity of the abundance patterns for metal-poor GCs in different environments points to similar early enrichment histories and only allow for minor variations in the initial mass function.

79 ASTRONOMY AND ASTROPHYSICS↗

NASA NTRS1983

The intermediate wavelength magnetic anomaly field of the north Pacific and possible source distributions

A technique that eliminates external field sources and the effects of strike aliasing was used to extract from marine survey data the intermediate wavelength magnetic anomaly field for (B) in the North Pacific. A strong correlation exists between this field and the MAGSAT field although a directional sensitivity in the MAGSAT field can be detected. The intermediate wavelength field is correlated to tectonic features. Island arcs appear as positive anomalies of induced origin likely due to variations in crustal thickness. Seamount chains and oceanic plateaus also are manifested by strong anomalies. The primary contribution to many of these anomalies appears to be due to a remanent magnetization. The source parameters for the remainder of these features are presently unidentified ambiguous. Results indicate that the sea surface field is a valuable source of information for secular variation analysis and the resolution of intermediate wavelength source parameters.

Labrecque, J. L.↗

NASA NTRS1985

Intermediate-wavelength magnetic anomaly field of the North Pacific and posible source distributions

A technique that eliminates external field sources and the effects of strike aliasing was used to extract from marine survey data the intermediate wavelength magnetic anomaly field for (B) in the North Pacific. A strong correlation exists between this field and the Magsat field although a directional sensitivity in the Magsat field can be detected. The intermediate wavelength field is correlated to tectonic features. Island arcs appear as positive anomalies of induced origin likely due to variations in crustal thickness. Seamount chains and oceanic plateaus also are manifested by strong anomalies. The primary contribution to many of these anomalies appears to be due to a remanent magnetization. The source parameters for the remainder of these features are presently unidentified ambiguous. Results indicate that the sea surface field is a valuable source of information for secular variation analysis and the resolution of intermediate wavelength source parameters.

Labrecque, J. L.↗

NASA NTRS2023

Quantification of Global Cloud Properties with Use of Spherical Harmonic Functions

Spherical harmonic (SH) expansion is a useful tool to study any variable that has valid values at all latitudes and longitudes. The variable can be quantified as a sum of different spherical harmonic components, which are the spherical harmonic functions multiplied by their expansion coefficients. We find that the SH components of cloud radiative effect (CRE) have correlations with El Niño-Southern Oscillation (ENSO) and the Hadley Circulation (HC). In particular, the expansion degree 2 (l = 2) SH power spectrum component anomaly of CRE is strongly correlated with ENSO. The two dipole patterns appearing in the l = 2 SH component anomaly map can be reasonably explained by a known mechanism of ENSO’s impact on cloud properties. The l = 3 and l = 5 SH power spectrum components are correlated with HC intensity, whereas the l = 6 and l = 8 components are correlated with HC latitudinal widths. In ENSO warm and cold phases, the HC-correlated SH components have opposite anomalies, which suggests the impact of ENSO on HC. This study illustrates that the SH expansion technique provides a different perspective to study the impacts of large-scale atmospheric circulation on global cloud properties and radiative effects.

clouds↗

DOE OSTI2024

Tunable Collective Excitations in Epitaxial Perovskite Nickelates

The formation of plasmons through the collective excitation of charge density has generated intense discussions, offering insights to fundamental sciences and potential applications. While the underlying physical principles have been well-established, the effects of multibody interactions and orbital hybridization on plasmonic dynamics remain understudied. Here, in this work, we present the observation of conventional metallic and correlated plasmons in epitaxial La 1-x Sr x NiO 3 (LSNO) films with varying Sr doping concentrations (x = 0, 0.125, 0.25), unveiling their intriguing evolution. Unlike samples at other doping concentrations, the x = 0.125 intermediate doping sample does not exhibit the correlated plasmons despite showing high optical conductivity. Through experimental investigation using spectroscopic ellipsometry and X-ray absorption spectroscopy, that is further supported by theoretical calculations, the O2p-Ni3d orbital hybridization for x = 0.125 is found to be significantly enhanced, alongside a considerable weakening of its effective interaction comprising long-range Coulomb and variable interaction, U*. These factors account for the absence of correlated plasmons and the high optical conductivity observed in LSNO(0.125). Our findings highlight the significant impact of orbital hybridization on the electronic structures and the formation of quasiparticles in strongly correlated systems, opening new paths for plasmonic-based engineering research.

36 MATERIALS SCIENCE↗

DOE OSTI2024

The dynamic adsorption affinity of ligands is a surrogate for the passivation of surface defects

Abstract Surface defects in semiconducting materials, though they have been widely studied, remain a prominent source of loss in optoelectronic devices; here we sought a new angle of approach, looking into the dynamic roles played by surface defects under atmospheric stressors and their chemical passivants in the lifetime of optoelectronic materials. We find that surface defects possess properties distinct from those of bulk defects. ab initio molecular dynamics simulations reveal a previously overlooked reversible degradation mechanism mediated by hydrogen vacancies. We find that dynamic surface adsorption affinity (DAA) relative to surface treatment ligands is a surrogate for passivation efficacy, a more strongly-correlated feature than is the static binding strength emphasized in prior reports. This guides us to design targeted passivator ligands with high molecular polarity: for example, 4-aminobutylphosphonic acid exhibits strong DAA and provides defect passivation applicable to a range of perovskite compositions, including suppressed hydrogen vacancy formation, enhanced photovoltaic performances and operational stability in perovskite solar cells.

Science & Technology - Other Topics↗