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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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All sourcesNASA NTRSDOE OSTI
DOE OSTI2022

Experimental Measurement of Out-of-Time-Ordered Correlators at Finite Temperature

Out-of-time-ordered correlators (OTOCs) are a key observable in a wide range of interconnected fields including many-body physics, quantum information science, and quantum gravity. Measuring OTOCs using near-term quantum simulators will extend our ability to explore fundamental aspects of these fields and the subtle connections between them. Here, we demonstrate an experimental method to measure OTOCs at finite temperatures and use the method to study their temperature dependence. These measurements are performed on a digital quantum computer running a simulation of the transverse field Ising model. Our flexible method, based on the creation of a thermofield double state, can be extended to other models and enables us to probe the OTOC’s temperature-dependent decay rate. Measuring this decay rate opens up the possibility of testing the fundamental temperature-dependent bounds on quantum information scrambling.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2016

SIMULATING THE TIMESCALE-DEPENDENT COLOR VARIATION IN QUASARS WITH A REVISED INHOMOGENEOUS DISK MODEL

The UV–optical variability of active galactic nuclei and quasars is useful for understanding the physics of the accretion disk and is gradually being attributed to stochastic fluctuations over the accretion disk. Quasars generally appear bluer when they brighten in the UV–optical bands; the nature of this phenomenon remains controversial. Recently, Sun et al. discovered that the color variation of quasars is timescale-dependent, in the way that faster variations are even bluer than longer term ones. While this discovery can directly rule out models that simply attribute the color variation to contamination from the host galaxies, or to changes in the global accretion rates, it favors the stochastic disk fluctuation model as fluctuations in the inner-most hotter disk could dominate the short-term variations. In this work, we show that a revised inhomogeneous disk model, where the characteristic timescales of thermal fluctuations in the disk are radius-dependent (i.e., τ ∼ r ; based on that originally proposed by Dexter and Agol), can reproduce well a timescale-dependent color variation pattern, similar to the observed one and unaffected by the uneven sampling and photometric error. This demonstrates that one may statistically use variation emission at different timescales to spatially resolve the accretion disk in quasars, thus opening a new window with which to probe and test the accretion disk physics in the era of time domain astronomy. Caveats of the current model, which ought to be addressed in future simulations, are discussed.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2018

Radiocesium interaction with clay minerals: Theory and simulation advances Post–Fukushima

Insights at the microscopic level of the process of radiocesium adsorption and interaction with clay mineral particles have improved substantially over the past several years, triggered by pressing social issues such as management of huge amounts of waste soil accumulated after the Fukushima Dai-ichi nuclear power plant accident. In particular, computer-based molecular modeling supported by advanced hardware and algorithms has proven to be a powerful approach. Its application can now generally encompass the full complexity of clay particle adsorption sites from basal surfaces to interlayers with inserted water molecules, to edges including fresh and weathered frayed ones. On the other hand, its methodological schemes are now varied from traditional force-field molecular dynamics on large-scale realizations composed of many thousands of atoms including water molecules to first-principles methods on smaller models in rather exacting fashion. In this article, we overview new understanding enabled by simulations across methodological variations, focusing on recent insights that connect with experimental observations, namely: 1) the energy scale for cesium adsorption on the basal surface, 2) progress in understanding the structure of clay edges, which is difficult to probe experimentally, 3) cesium adsorption properties at hydrated interlayer sites, 4) the importance of the size relationship between the ionic radius of cesium and the interlayer distance at frayed edge sites, 5) the migration of cesium into deep interlayer sites, and 6) the effects of nuclear decay of radiocesium. Key experimental observations that motivate these simulation advances are also summarized. Furthermore, some directions toward future solutions of waste soil management are discussed based on the obtained microscopic insights.

54 ENVIRONMENTAL SCIENCES↗
NASA NTRS2006

Numerical Modeling of Flow Control in a Boundary-Layer-Ingesting Offset Inlet Diffuser at Transonic Mach Numbers

This paper will investigate the validation of the NASA developed, Reynolds-averaged Navier-Stokes (RANS) flow solver, OVERFLOW, for a boundary-layer-ingesting (BLI) offset (S-shaped) inlet in transonic flow with passive and active flow control devices as well as a baseline case. Numerical simulations are compared to wind tunnel results of a BLI inlet experiment conducted at the NASA Langley 0.3-Meter Transonic Cryogenic Tunnel. Comparisons of inlet flow distortion, pressure recovery, and inlet wall pressures are performed. The numerical simulations are compared to the BLI inlet data at a free-stream Mach number of 0.85 and a Reynolds number of approximately 2 million based on the fanface diameter. The numerical simulations with and without tunnel walls are performed, quantifying tunnel wall effects on the BLI inlet flow. A comparison is made between the numerical simulations and the BLI inlet experiment for the baseline and VG vane cases at various inlet mass flow rates. A comparison is also made to a BLI inlet jet configuration for varying actuator mass flow rates at a fixed inlet mass flow rate. Overall, the numerical simulations were able to predict the baseline circumferential flow distortion, DPCP avg, very well within the designed operating range of the BLI inlet. A comparison of the average total pressure recovery showed that the simulations were able to predict the trends but had a negative 0.01 offset when compared to the experimental levels. Numerical simulations of the baseline inlet flow also showed good agreement with the experimental inlet centerline surface pressures. The vane case showed that the CFD predicted the correct trends in the circumferential distortion levels for varying inlet mass flow but had a distortion level that was nearly twice as large as the experiment. Comparison to circumferential distortion measurements for a 15 deg clocked 40 probe rake indicated that the circumferential distortion levels are very sensitive to the symmetry of the flow and that a misalignment of the vanes in the experiment could have resulted in this difference. The numerical simulations of the BLI inlet with jets showed good agreement with the circumferential inlet distortion levels for a range of jet actuator mass flow ratios at a fixed inlet mass flow rate. The CFD simulations for the jet case also predicted an average total pressure recovery offset that was 0.01 lower than the experiment as was seen in the baseline. Comparisons of the flow features for the jet cases revealed that the CFD predicted a much larger vortex at the engine fan-face when compare to the experiment.

Allan, Brian G.↗
DOE OSTI2015

First frontier field constraints on the cosmic star formation rate density AT z ~ 10—the impact of lensing shear on completeness of high-redshift galaxy samples

In this work, we search the complete Hubble Frontier Field data set of Abell 2744 and its parallel field for $z\sim 10$ sources to further refine the evolution of the cosmic star formation rate density (SFRD) between $z\sim 8$ and $z\sim 10$. We independently confirm two images of the recently discovered triply imaged $z\sim 9.8$ source by Zitrin et al. and set an upper limit for similar $z\sim 10$ galaxies with red colors of ${J}_{125}-{H}_{160}\gt 1.2$ in the parallel field of Abell 2744. We utilize extensive simulations to derive the effective selection volume of Lyman-break galaxies at $z\sim 10$, both in the lensed cluster field and in the adjacent parallel field. Particular care is taken to include position-dependent lensing shear to accurately account for the expected sizes and morphologies of highly magnified sources. We show that both source blending and shear reduce the completeness at a given observed magnitude in the cluster, particularly near the critical curves. These effects have a significant, but largely overlooked, impact on the detectability of high-redshift sources behind clusters, and substantially reduce the expected number of highly magnified sources. The detections and limits from both pointings result in an SFRD which is consistent within the uncertainties with previous estimates at $z\sim 10$ from blank fields. The combination of these new results with all other estimates is also consistent with a rapidly declining SFRD in the 170 Myr from $z\sim 8$ to $z\sim 10$ as predicted by cosmological simulations and dark-matter halo evolution in ΛCDM. Once biases introduced by magnification-dependent completeness are accounted for, the full six cluster and parallel Frontier Field program will be an extremely powerful new data set to probe the evolution of the galaxy population at $z\gt 8$ before the advent of the James Webb Space Telescope.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2020

Development of Mockups and Instrumentation for Spent Fuel Drying Tests

The purpose of this report is to provide updates on the experimental components, methodology, and instrumentation under development for use in advanced studies of realistic drying operations conducted on surrogate spent nuclear fuel. Validation of the extent of water removal in a dry spent nuclear fuel storage system based on drying procedures used at nuclear power plants is needed to close existing technical gaps. Operational conditions leading to incomplete drying may have potential impacts on the fuel, cladding, and other components in the system. Water remaining in canisters upon completion of drying procedures can lead to cladding corrosion, embrittlement, and breaching, as well as fuel degradation. Additional information is needed on the drying process efficacy to help evaluate the potential impacts of water retention on extended longterm dry storage. A general lack of data suitable for model validation of commercial nuclear canister drying processes necessitates additional, well-designed investigations. Smaller-scale tests that incorporate relevant physics and well-controlled boundary conditions are essential to provide insight and guidance to the simulation of prototypic systems undergoing drying processes. This report describes the implementation of moisture monitoring equipment on a pressurized, submersible system employing a single waterproof, electrically heated spent fuel rod simulator as a demonstration of analytical capabilities during a drying process. A mass spectrometer with specially designed inlets was used to monitor moisture and other gases at 150 kPa to 800 kPa for a test simulating a forced helium dehydration procedure and below 1 torr for tests mimicking a vacuum drying process. The dew point data from the mass spectrometer was found to be in good agreement with a solid-state moisture probe. A distinct advantage of the mass spectrometer system was the capability to directly sample from the hightemperature (>200 °C) head space expected in a prototypic scale experiment where a solid-state moisture probe would suffer considerable loss of accuracy or fail altogether. The operational and analytical experiences gained from this test series are poised to support an expansion to assembly-scale tests at prototypic length. These assemblies are designed to feature prototypic assembly hardware, advanced diagnostics for in situ internal rod pressure monitoring, and failed fuel rod simulators with engineered cladding defects to challenge the drying system with waterlogged fuel.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗
DOE OSTI2014

Cosmological parameter uncertainties from SALT-II type Ia supernova light curve models

We use simulated type Ia supernova (SN Ia) samples, including both photometry and spectra, to perform the first direct validation of cosmology analysis using the SALT-II light curve model. This validation includes residuals from the light curve training process, systematic biases in SN Ia distance measurements, and a bias on the dark energy equation of state parameter w. Using the SN-analysis package SNANA, we simulate and analyze realistic samples corresponding to the data samples used in the SNLS3 analysis: ∼120 low-redshift (z < 0.1) SNe Ia, ∼255 Sloan Digital Sky Survey SNe Ia (z < 0.4), and ∼290 SNLS SNe Ia (z ≤ 1). To probe systematic uncertainties in detail, we vary the input spectral model, the model of intrinsic scatter, and the smoothing (i.e., regularization) parameters used during the SALT-II model training. Using realistic intrinsic scatter models results in a slight bias in the ultraviolet portion of the trained SALT-II model, and w biases (w {sub input} – w {sub recovered}) ranging from –0.005 ± 0.012 to –0.024 ± 0.010. These biases are indistinguishable from each other within the uncertainty; the average bias on w is –0.014 ± 0.007.

79 ASTRONOMY AND ASTROPHYSICS↗
NASA NTRS2006

Numerical Modeling of Flow Control in a Boundary-Layer-Ingesting Offset Inlet Diffuser at Transonic Mach Numbers

This paper will investigate the validation of a NASA developed, Reynolds-averaged Navier-Stokes (RANS) flow solver, OVERFLOW, for a boundary-layer-ingesting (BLI) offset (S-shaped) inlet in transonic flow with passive and active flow control devices as well as the baseline case. Numerical simulations are compared to wind tunnel results of a BLI inlet conducted at the NASA Langley 0.3-Meter Transonic Cryogenic Tunnel. Comparisons of inlet flow distortion, pressure recovery, and inlet wall pressures are performed. The numerical simulations are compared to the BLI inlet data at a freestream Mach number of 0.85 and a Reynolds number of approximately 2 million based on the length of the fan-face diameter. The numerical simulations with and without wind tunnel walls are performed, quantifying effects of the tunnel walls on the BLI inlet flow measurements. The wind tunnel test evaluated several different combinations of jet locations and mass flow rates as well as a vortex generator (VG) vane case. The numerical simulations will be performed on a single jet configuration for varying actuator mass flow rates at a fix inlet mass flow condition. Validation of the numerical simulations for the VG vane case will also be performed for varying inlet mass flow rates. Overall, the numerical simulations were able to predict the baseline circumferential flow distortion, DPCPavg, very well for comparisons made within the designed operating range of the BLI inlet. However the CFD simulations did predict a total pressure recovery that was 0.01 lower than the experiment. Numerical simulations of the baseline inlet flow also showed good agreement with the experimental inlet centerline surface pressures. The vane case showed that the CFD predicted the correct trends in the circumferential distortion for varying inlet mass flow but had a distortion level that was nearly twice as large as the experiment. Comparison to circumferential distortion measurements for a 15 deg clocked 40 probe rake indicated that the circumferential distortion levels are very sensitive to the symmetry of the flow and that a miss alignment of the vanes in the experiment could have resulted in this difference. The numerical simulations of the BLI inlet with jets showed good agreement with the circumferential inlet distortion levels for a range of jet actuator mass flow ratios at a fixed inlet mass flow rate. The CFD simulations for the jet case also predicted an average total pressure recovery that was 0.01 lower than the experiment as was seen in the baseline. Comparison of the flow features the jet case revealed that the CFD predicted a much larger vortex at the engine fan-face when compare to the experiment.

Allan Brian G.↗
NASA NTRS2015

Computational Simulations of the 10-MW TP3 Arc-Jet Facility Flow

This paper reports computational simulations and analysis in support of calibration tests in a high enthalpy arc-jet facility at NASA Ames Research Center. These tests were conducted using stagnation calorimeters and two different blunted wedge models with calibration plates at a wide range of conditions in the NASA Ames 10-megawatt TP3 (Test Position 3) facility. Data were obtained using four different conical nozzles with the same test configuration in which the models were placed in a free jet downstream of the nozzle. Experimental surveys of arc-jet test flow with pitot and null-point heat flux probes were also performed at several arc-heater conditions, providing assessment of the flow uniformity and valuable data for the flow characterization. The present analysis comprises computational fluid dynamics simulations of the nonequilibrium flowfield in the facility nozzle and test box, including the models tested, and comparisons with the experimental measurements. These computational simulations provide estimates of the arc-jet test environment parameters that are not measured but are needed to evaluate the performance of thermal protection system materials, along with further valuable insights into the arc-jet testing environment. Simulation results are used to estimate centerline total enthalpy, surface shear, boundary layer thickness, and boundary layer edge Mach number and to verify that specific test requirements from the Orion program are met.

CFD↗
DOE OSTI2015

Inelastic neutron scattering and molecular simulation of the dynamics of interlayer water in smectite clay minerals

The study of mineral–water interfaces is of great importance to a variety of applications including oil and gas extraction, gas subsurface storage, environmental contaminant treatment, and nuclear waste repositories. Understanding the fundamentals of that interface is key to the success of those applications. Confinement of water in the interlayer of smectite clay minerals provides a unique environment to examine the interactions among water molecules, interlayer cations, and clay mineral surfaces. Smectite minerals are characterized by a relatively low layer charge that allows the clay to swell with increasing water content. Montmorillonite and beidellite varieties of smectite were investigated to compare the impact of the location of layer charge on the interlayer structure and dynamics. Inelastic neutron scattering of hydrated and dehydrated cation-exchanged smectites was used to probe the dynamics of the interlayer water (200–900 cm –1 spectral region) and identify the shift in the librational edge as a function of the interlayer cation. Molecular dynamics simulations of equivalent phases and power spectra, derived from the resulting molecular trajectories, indicate a general shift in the librational behavior with interlayer cation that is generally consistent with the neutron scattering results for the monolayer hydrates. Both neutron scattering and power spectra exhibit librational structures affected by the location of layer charge and by the charge of the interlayer cation. Furthermore, divalent cations (Ba 2+ and Mg 2+ ) characterized by large hydration enthalpies typically exhibit multiple broad librational peaks compared to monovalent cations (Cs + and Na + ), which have relatively small hydration enthalpies.

36 MATERIALS SCIENCE↗
DOE OSTI2015

Full quantum mechanical analysis of atomic three-grating Mach–Zehnder interferometry

Atomic three-grating Mach–Zehnder interferometry constitutes an important tool to probe fundamental aspects of the quantum theory. There is, however, a remarkable gap in the literature between the oversimplified models and robust numerical simulations considered to describe the corresponding experiments. Consequently, the former usually lead to paradoxical scenarios, such as the wave–particle dual behavior of atoms, while the latter make difficult the data analysis in simple terms. Here these issues are tackled by means of a simple grating working model consisting of evenly-spaced Gaussian slits. As is shown, this model suffices to explore and explain such experiments both analytically and numerically, giving a good account of the full atomic journey inside the interferometer, and hence contributing to make less mystic the physics involved. More specifically, it provides a clear and unambiguous picture of the wavefront splitting that takes place inside the interferometer, illustrating how the momentum along each emerging diffraction order is well defined even though the wave function itself still displays a rather complex shape. To this end, the local transverse momentum is also introduced in this context as a reliable analytical tool. The splitting, apart from being a key issue to understand atomic Mach–Zehnder interferometry, also demonstrates at a fundamental level how wave and particle aspects are always present in the experiment, without incurring in any contradiction or interpretive paradox. On the other hand, at a practical level, the generality and versatility of the model and methodology presented, makes them suitable to attack analogous problems in a simple manner after a convenient tuning. - Highlights: • A simple model is proposed to analyze experiments based on atomic Mach–Zehnder interferometry. • The model can be easily handled both analytically and computationally. • A theoretical analysis based on the combination of the position and momentum representations is considered. • Wave and particle aspects are shown to coexist within the same experiment, thus removing the old wave-corpuscle dichotomy. • A good agreement between numerical simulations and experimental data is found without appealing to best-fit procedures.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2024

Pivotal Roles of Triple Screening-Topological, Electrostatic, and Hydrodynamic-On Dynamics in Semidilute Polyelectrolyte Solutions

For semidilute polyelectrolyte solutions, it is generally assumed that topological, electrostatic, and hydrodynamic interactions are screened (called triple screening). Despite a large body of research focused on polyelectrolyte solutions, the concept of triple screening has never been rigorously verified. In this work, we test the concept by probing concentration fluctuations in aqueous solutions containing a well-studied polyelectrolyte, sodium poly(styrenesulfonate) (NaPSS) with neutron scattering, theory, and molecular dynamics simulations. Neutron spin–echo (NSE) and small-angle neutron scattering (SANS) data from semidilute solutions of NaPSS are presented at different polymer and salt (NaCl) concentrations. A combined theory for structure (J. Chem. Phys. 105, 5183 (1996)) and dynamics (J. Chem. Phys. 107, 2619 (1997)), which captures effects of hydrodynamic, topological, and electrostatic screening, is used to interpret the experimental results. Here, the theory quantitatively predicts the decay rate obtained from the NSE measurements while capturing the shape and concentration dependencies of the polyelectrolyte peak observed in the SANS spectra. Detailed comparisons of the theory and the experiments reveal that the wavevector-dependent decay rate of concentration fluctuations in semidilute solutions of polyelectrolytes is dictated by the screening of hydrodynamic, topological, and electrostatic interactions. This conclusion is corroborated by coarse-grained molecular dynamics simulations, executed without any hydrodynamic interactions, which fail to capture the correct wavevector dependence of the decay rate. These results highlight that the theories based on the concept of triple screening provide a quantitative framework for predicting a relation between the structure and dynamics of polyelectrolyte solutions.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2021

Safely probing the chemistry of Chernobyl nuclear fuel using micro-focus X-ray analysis

Detailed chemical analysis of the solidified molten fuel still residing in the stricken Chernobyl reactor unit 4 are inferred using multi-modal micro-focus X-ray analysis of a low-radioactivity proxy. A fascinating mixture of molten UO 2 , nuclear fuel cladding, concrete, stainless steel and other nuclear reactor components, these materials behaved like lava, solidifying to form a complex, highly radioactive glass-ceramic. Using element-specific chemical probes (micro-X-ray fluorescence and X-ray absorption spectroscopy), coupled with micro-diffraction analysis, the crystalline phase assemblage of simulants of these heterogeneous materials was established, which included “chernobylite” and a range of compositions in the (U 1-x Zr x )O 2 solid solution. Novel insight to nuclear accident fuel chemistry was obtained by establishing the oxidation state and local coordination of uranium not only in these crystalline phases, but uniquely in the amorphous fraction of the material, which varied depending on the history of the nuclear lava as it flowed through the reactor. This study demonstrates that micro-focus X-ray analysis of very small fractions of material can yield rich chemical information, which can be applied to nuclear-melt down materials to aid decommissioning and nuclear fuel management at nuclear accident sites.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗
DOE OSTI2023

Ion and water adsorption to graphene and graphene oxide surfaces

Graphene and graphene oxide (GO) are two particularly promising nanomaterials for a range of applications including energy storage, catalysis, and separations. Understanding the nanoscale interactions between ions and water near graphene and GO surfaces is critical for advancing our fundamental knowledge of these systems and downstream application success. Here this minireview highlights the necessity of using surface-specific experimental probes and computational techniques to fully characterize these interfaces, including the nanomaterial, surrounding water, and any adsorbed ions, if present. Key experimental and simulation studies considering water and ion structures near both graphene and GO are discussed. The major findings are: water forms 1–3 hydration layers near graphene; ions adsorb electrostatically to graphene under an applied potential; the chemical and physical properties of GO vary considerably depending on the synthesis route; and these variations influence water and ion adsorption to GO. Lastly, we offer outlooks and perspectives for these research areas.

36 MATERIALS SCIENCE↗
DOE OSTI2018

Particle-in-cell simulations of anomalous transport in a Penning discharge

Electrostatic particle-in-cell simulations of a Penning discharge are performed in order to investigate azimuthally asymmetric, spoke-like structures previously observed in experiments. Two-dimensional simulations show that for Penning-discharge conditions, a persistent nonlinear spoke-like structure forms readily and rotates in the direction of E × B and electron diamagnetic drifts. The azimuthal velocity is within about a factor of 2 of the ion acoustic speed. The spoke frequency follows the experimentally observed scaling with ion mass, which indicates the importance of ion inertia in spoke formation. The spoke provides enhanced (anomalous) radial electron transport, and the effective cross-field conductivity is several times larger than the classical (collisional) value. The level of anomalous current obtained in the simulations is in good agreement with the experimental data. Furthermore, the rotating spoke channels most of the radial current, observable by an edge probe as short pulses.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2025

Infrared spectral signatures of interfacial water at TiO 2 –electrolyte interfaces from deep potential molecular dynamics

Vibrational spectroscopy is a powerful tool for probing water at oxide–electrolyte interfaces, but its molecular interpretation can be challenging. Here, we employ deep potential long-range molecular dynamics simulations with layer-resolved spectral analysis to investigate the microscopic origins of the infrared (IR) response of water at the interface with anatase TiO 2 (101), a prototypical oxide surface. The calculated interfacial spectra exhibit characteristic modifications compared to bulk water IR spectra, including enhanced intensities, a red shifted and broadened stretching band, and a higher-frequency shoulder, in qualitative agreement with experiments. Spectral decomposition shows that these signatures originate mainly from the first interfacial water layer, dominated by surface-bound H 2 O at Ti 5C sites, with secondary contributions from the second layer. A moderate salt concentration (0.4 M NaCl) leaves both the interfacial structure and the spectra essentially unchanged, while tuning the pH strongly modulates the spectral intensity. We establish a scaling relation linking the spectral intensity to the surface water dissociation fraction and the dipole moment, both governed by interfacial electric fields. These findings provide a microscopic framework for interpreting IR spectra of oxide–electrolyte interfaces.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2013

DARK MATTER HALO PROFILES OF MASSIVE CLUSTERS: THEORY VERSUS OBSERVATIONS

Dark-matter-dominated cluster-scale halos act as an important cosmological probe and provide a key testing ground for structure formation theory. Focusing on their mass profiles, we have carried out (gravity-only) simulations of the concordance {Lambda}CDM cosmology, covering a mass range of 2 Multiplication-Sign 10{sup 12} to 2 Multiplication-Sign 10{sup 15} h {sup -1} M{sub Sun} and a redshift range of z = 0-2, while satisfying the associated requirements of resolution and statistical control. When fitting to the Navarro-Frenk-White profile, our concentration-mass (c-M) relation differs in normalization and shape in comparison to previous studies that have limited statistics in the upper end of the mass range. We show that the flattening of the c-M relation with redshift is naturally expressed if c is viewed as a function of the peak height parameter, {nu}. Unlike the c-M relation, the slope of the c-{nu} relation is effectively constant over the redshift range z = 0-2, while the amplitude varies by {approx}30% for massive clusters. This relation is, however, not universal: using a simulation suite covering the allowed wCDM parameter space, we show that the c-{nu} relation varies by about {+-}20% as cosmological parameters are varied. At fixed mass, the c(M) distribution is well fit by a Gaussian with {sigma}{sub c}/(c) {approx_equal} 1/3, independent of the radius at which the concentration is defined, the halo dynamical state, and the underlying cosmology. We compare the {Lambda}CDM predictions with observations of halo concentrations from strong lensing, weak lensing, galaxy kinematics, and X-ray data, finding good agreement for massive clusters (M{sub vir} > 4 Multiplication-Sign 10{sup 14} h {sup -1} M{sub Sun }), but with some disagreements at lower masses. Because of uncertainty in observational systematics and modeling of baryonic physics, the significance of these discrepancies remains unclear.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2014

SPECTRAL VARIABILITY FROM THE PATCHY ATMOSPHERES OF T AND Y DWARFS

Brown dwarfs of a variety of spectral types have been observed to be photometrically variable. Previous studies have focused on objects at the L/T transition, where the iron and silicate clouds in L dwarfs break up or dissipate. However, objects outside of this transitional effective temperature regime also exhibit variability. Here, we present models for mid-late T dwarfs and Y dwarfs. We present models that include patchy salt and sulfide clouds as well as water clouds for the Y dwarfs. We find that for objects over 375 K, patchy cloud opacity would generate the largest amplitude variability within near-infrared spectral windows. For objects under 375 K, water clouds also become important and generate larger amplitude variability in the mid-infrared. We also present models in which we perturb the temperature structure at different pressure levels of the atmosphere to simulate hot spots. These models show the most variability in the absorption features between spectral windows. The variability is strongest at wavelengths that probe pressure levels at which the heating is the strongest. The most illustrative types of observations for understanding the physical processes underlying brown dwarf variability are simultaneous, multi-wavelength observations that probe both inside and outside of molecular absorption features.

79 ASTRONOMY AND ASTROPHYSICS↗