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Calendar Year 2011 Groundwater Monitoring Report, U.S. Department of Energy Y-12 National Security Complex

This report contains the groundwater and surface water monitoring data that were obtained during calendar year (CY) 2011 at the U.S. Department of Energy (DOE) Y-12 National Security Complex (Y-12) on the DOE Oak Ridge Reservation (ORR) in Oak Ridge, Tennessee. The CY 2011 monitoring data were obtained from wells, springs, and surface water sampling locations in three hydrogeologic regimes at Y-12. The Bear Creek Hydrogeologic Regime (Bear Creek Regime) encompasses a section of Bear Creek Valley (BCV) between the west end of Y-12 and the west end of the Bear Creek Watershed (directions are in reference to the Y-12 grid system). The Upper East Fork Poplar Creek Hydrogeologic Regime (East Fork Regime) encompasses the Y-12 industrial facilities and support structures in BCV. The Chestnut Ridge Hydrogeologic Regime (Chestnut Ridge Regime) encompasses a section of Chestnut Ridge directly south of Y-12. This report provides background information pertinent to groundwater and surface water quality monitoring in each hydrogeologic regime, including the topography and bedrock geology, surface water drainage, groundwater system, and known extent of groundwater contamination.

54 ENVIRONMENTAL SCIENCES↗

Energy-resolved attosecond interferometric photoemission from Ag(111) and Au(111) surfaces

Photoelectron emission from solid surfaces induced by attosecond pulse trains into the electric field of delayed phase-coherent infrared (IR) pulses allows the surface-specific observation of energy-resolved electronic phase accumulations and photoemission delays. Here, we quantum-mechanically modeled interferometric photoemission spectra from the (111) surfaces of Au and Ag, including background contributions from secondary electrons and direct emission by the IR pulse, and adjusted parameters of our model to energy-resolved photoelectron spectra recently measured at a synchrotron light source by Roth et al. [J. Electron Spectrosc. 224, 84 (2018)]. Our calculated spectra and photoelectron phase shifts are in fair agreement with the experimental data of Locher et al. [Optica 2, 405 (2015)]. Our model's not reproducing the measured energy-dependent oscillations of the Ag(111) photoemission phases may be interpreted as evidence for subtle band-structure effects on the final-state photoelectron-surface interaction not accounted for in our simulation.

74 ATOMIC AND MOLECULAR PHYSICS↗

Calendar Year 2010 Groundwater Monitoring Report, U.S. Department Of Energy Y-12 National Security Complex, Oak Ridge, Tennessee

This report contains the groundwater and surface water monitoring data that were obtained during calendar year (CY) 2010 at the U.S. Department of Energy (DOE) Y-12 National Security Complex (hereafter referenced as Y-12) on the DOE Oak Ridge Reservation (ORR) in Oak Ridge, Tennessee. The CY 2010 monitoring data were obtained from wells, springs, and surface water sampling locations in three hydrogeologic regimes at Y-12 (Figure A.1). The Bear Creek Hydrogeologic Regime (Bear Creek Regime) encompasses a section of Bear Creek Valley (BCV) between the west end of Y-12 and the west end of the Bear Creek Watershed (directions are in reference to the Y-12 grid system). The Upper East Fork Poplar Creek Hydrogeologic Regime (East Fork Regime) encompasses the Y-12 industrial facilities and support structures in BCV. The Chestnut Ridge Hydrogeologic Regime (Chestnut Ridge Regime) encompasses a section of Chestnut Ridge directly south of Y-12. Section 2 of this report provides background information pertinent to groundwater and surface water quality monitoring in each hydrogeologic regime, including the topography and bedrock geology, surface water drainage, groundwater system, and extent of groundwater contamination. The CY 2010 groundwater and surface water monitoring data in this report were obtained from sampling and analysis activities implemented under the Y-12 Groundwater Protection Program (GWPP) managed by Babcock & Wilcox Technical Services Y-12, LLC (B&W Y-12) and from sampling and analysis activities implemented under several monitoring programs managed by Bechtel Jacobs Company LLC (BJC). Cooperative implementation of the monitoring programs directed by the Y-12 GWPP and BJC (i.e., coordinating sample collection and sharing data) ensures that the CY 2010 monitoring results fulfill requirements of all the applicable monitoring drivers with no duplication of sampling and analysis efforts. Section 3 of this report contains a summary of information regarding the groundwater and surface water sampling and analysis activities implemented under the Y-12 GWPP including sampling locations and frequency; quality assurance (QA)/quality control (QC) sampling; sample collection and handling; field measurements and laboratory analytes; data management and data quality objective (DQO) evaluation; and groundwater elevation monitoring. However, this report does not include equivalent QA/QC or DQO evaluation information regarding the groundwater and surface water sampling and analysis activities associated with the monitoring programs implemented by BJC. Such details are deferred to the respective programmatic plans and reports issued by BJC (see Section 3.0). Collectively, the groundwater and surface water monitoring data obtained during CY 2010 by the Y-12 GWPP and BJC address DOE Order 450.1A (Environmental Protection Program) requirements for monitoring groundwater and surface water quality in areas: (1) which are, or could be, affected by operations at Y-12 (surveillance monitoring); and (2) where contaminants from Y-12 are most likely to migrate beyond the boundaries of the ORR (exit pathway/perimeter monitoring). Section 4 of this report presents a summary evaluation of the monitoring data with regard to the respective objectives of surveillance monitoring and exit pathway/perimeter monitoring, based on the analytical results for the principal groundwater contaminants at Y-12: nitrate, uranium, volatile organic compounds (VOCs), gross alpha activity, and gross beta activity. Section 5 of this report summarizes the most pertinent findings regarding the principal contaminants, along with recommendations proposed for ongoing groundwater and surface water quality monitoring performed under the Y-12 GWPP.

54 ENVIRONMENTAL SCIENCES↗

Lower Urban Humidity Moderates Outdoor Heat Stress

Abstract Surface temperature is often used to examine heat exposure in multi‐city studies and for informing urban heat mitigation efforts due to scarcity of urban air temperature measurements. Cities also have lower relative humidity, traditionally not accounted for in large‐scale observational urban heat risk assessments. Here, using crowdsourced measurements from over 40,000 weather stations in ≈600 urban clusters in Europe, we show the moderating effect of this urbanization‐induced humidity reduction on outdoor heat stress during the 2019 heatwave. We demonstrate that daytime differences in heat index between urban clusters and their surroundings are weak, and associations of this urban‐rural difference with background climate, generally examined from the surface temperature perspective, are diminished due to moisture feedbacks. We also examine the spatial variability of surface temperature, air temperature, and heat index within these clusters—relevant for detecting hotspots and potential disparities in heat exposure—and find that surface temperature is a poor proxy for the intra‐urban distribution of heat index during daytime. Finally, urban vegetation shows much weaker (∼1/6th as strong) associations with heat index than with surface temperature, which has broad implications for optimizing urban heat stress mitigation strategies. These findings are valid for operational metrics of heat stress for shaded conditions (apparent temperature and humidex), thermodynamic proxies (wet‐bulb temperature), and empirical heat indices. Based on this large‐scale empirical evidence, surface temperature, used due to the lack of better alternatives, may not be suitable for accurately informing heat mitigation strategies within and across cities, necessitating more urban‐scale observations and better urban‐resolving models.

54 ENVIRONMENTAL SCIENCES↗

Comprehensive study of radon progeny attachment to surfaces

Low energy, low rate experiments, such as searches for neutrinoless double β decay and dark matter, require unprecedentedly low levels of background in order to deliver their full science potential. 210 Po driven, neutron induced background, caused by nuclear (α, n) reactions on low-Z materials, direct background contributions of the 210 Po α radiation and desorption of the 210 Pb progeny 210 Bi from surfaces into the detector medium are of particular of concern. These backgrounds depend on details of the components’ exposure to radon-loaded laboratory air and, thus, their handling history. The attachment rates of airborne radon progeny to surfaces, needed for the estimation of these background rates, are poorly understood. This article reports the results of a campaign comprising of more than 1200 attachment measurements, performed for nine different materials. Correlations of the attachment with environmental parameters such as air exchange rate, electrical surface potential, temperature, atmospheric pressure, and relative humidity have been studied and found to be significant only in case of the first two. Attachment modeling, using the Jacobi model, is compared to data.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

Simulating the density of organic species in the atmosphere of Titan with a coupled ion-neutral photochemical model

We introduce a one-dimensional coupled ion-neutral photochemical kinetics and diffusion model to study the atmospheric composition of Titan in light of new theoretical kinetics calculations and scientific findings from the Cassini–Huygens mission. The model extends from the surface to the exobase. The atmospheric background, boundary conditions, vertical transport and aerosol opacity are all constrained by the Cassini–Huygens observations. The chemical network includes reactions between hydrocarbons, nitrogen and oxygen bearing species. It takes into account neutrals and both positive and negative ions with masses extending up to 116 and 74 u, respectively. We incorporate high-resolution isotopic photoabsorption and photodissociation cross sections for N 2 as well as new photodissociation branching ratios for CH 4 and C 2 H 2 . Ab initio transition state theory calculations are performed in order to estimate the rate coefficients and products for critical reactions. Critical reactions of production and loss for neutrals and ions are quantitatively assessed and thoroughly discussed. The vertical distributions of neutrals and ions predicted by the model generally reproduce observational data, suggesting that for the small species most chemical processes in Titan’s atmosphere and ionosphere are adequately described and understood; some differences are highlighted. Notable remaining issues include (i) the total positive ion density (essentially HCNH + ) in the upper ionosphere, (ii) the low mass negative ion densities (CN - , C 3 N - /C4H - ) in the upper atmosphere, and (iii) the minor oxygen-bearing species (CO 2 , H 2 O) density in the stratosphere. Pathways towards complex molecules and the impact of aerosols (UV shielding, atomic and molecular hydrogen budget, nitriles heterogeneous chemistry and condensation) are evaluated in the model, along with lifetimes and solar cycle variations.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

The Origin of Surface-Enhanced Raman Scattering of 4,4' -Biphenyldicarboxylate on Silver Substrates

We combine scanning electron microscopy, atomic force microscopy, surface-enhanced Raman scattering (SERS), and tools of computational chemistry to investigate the origin of Raman scattering of 4,4’-biphenyldicarboxylic acid adsorbed as 4,4’-biphenyldicarboxylate on two different silver substrates. The first consists of a 100 nm deep cylindrical aperture embedded in an array of cylindrical nano-holes featuring an average diameter of 350 nm and a periodicity of 700 nm. The second is a nano-junction formed by a 100 nm silver nano-particle coated with the adsorbate and a flat silver surface. We find that the underlying background signal in the SERS spectra collected from the former strongly resemble the SERS spectra of the nano-sphere-featuring substrate, engineered to operate in the charge transfer plasmon limit. Our analysis of a series of SERS spectra consecutively collected from one nano-cylinder suggests that the optical response of a single molecule can be extracted, its brightest Raman active mode enhanced by a factor of 7.4 x 106.

Environmental Molecular Sciences Laboratory↗

THE MID-INFRARED TULLY-FISHER RELATION: SPITZER SURFACE PHOTOMETRY

The availability of photometric imaging of several thousand galaxies with the Spitzer Space Telescope enables a mid-infrared calibration of the correlation between luminosity and rotation in spiral galaxies. The most important advantage of the new calibration in the 3.6 {mu}m band, IRAC Channel 1, is photometric consistency across the entire sky. Additional advantages are minimal obscuration, observations of flux dominated by old stars, and sensitivity to low surface brightness levels due to favorable backgrounds. Roughly 3000 galaxies have been observed through Spitzer cycle 7 and images of these are available from the Spitzer archive. In cycle 8, a program called Cosmic Flows with Spitzer was initiated, which will increase the available sample of spiral galaxies with inclinations greater than 45 Degree-Sign from face-on that are suitable for distance measurements by 1274. This paper describes procedures, based on the photometry package Archangel, that are being employed to analyze both the archival and new data in a uniform way. We give results for 235 galaxies, our calibrator sample for the Tully-Fisher relation. Galaxy magnitudes are determined with uncertainties held below 0.05 mag for normal spiral systems. A subsequent paper will describe the calibration of the [3.6] luminosity-rotation relation.

79 ASTRONOMY AND ASTROPHYSICS↗

The stellar halo of isolated central galaxies in the Hyper Suprime-Cam imaging survey

We study the faint stellar halo of isolated central galaxies, by stacking galaxy images in the HSC survey and accounting for the residual sky background sampled with random points. The surface brightness profiles in HSC r band are measured for a wide range of galaxy stellar masses (9.2 < log 10 M * /M ⊙ < 11.4) and out to 120 kpc. Failing to account for the stellar halo below the noise level of individual images will lead to underestimates of the total luminosity by ≤15%. Splitting galaxies according to the concentration parameter of their light distributions, we find that the surface brightness profiles of low-concentration galaxies drop faster between 20 and 100 kpc than those of high-concentration galaxies. Albeit the large galaxy-to-galaxy scatter, we find a strong self-similarity of the stellar halo profiles. They show unified forms once the projected distance is scaled by the halo virial radius. The colour of galaxies is redder in the centre and bluer outside, with high-concentration galaxies having redder and more flattened colour profiles. There are indications of a colour minimum, beyond which the colour of the outer stellar halo turns red again. This colour minimum, however, is very sensitive to the completeness in masking satellite galaxies. We also examine the effect of the extended PSF in the measurement of the stellar halo, which is particularly important for low-mass or low-concentration galaxies. The PSF-corrected surface brightness profile can be measured down to ~31 magarcsec -2 at 3σ significance. PSF also slightly flattens the measured colour profiles.

79 ASTRONOMY AND ASTROPHYSICS↗

Dark Energy Survey year 1 results: the relationship between mass and light around cosmic voids

What are the mass and galaxy profiles of cosmic voids? In this paper, we use two methods to extract voids in the Dark Energy Survey (DES) Year 1 redMaGiC galaxy sample to address this question. We use either 2D slices in projection, or the 3D distribution of galaxies based on photometric redshifts to identify voids. For the mass profile, we measure the tangential shear profiles of background galaxies to infer the excess surface mass density. The signal-to-noise ratio for our lensing measurement ranges between 10.7 and 14.0 for the two void samples. We infer their 3D density profiles by fitting models based on N-body simulations and find good agreement for void radii in the range 15–85 Mpc. Comparison with their galaxy profiles then allows us to test the relation between mass and light at the 10 per cent level, the most stringent test to date. We find very similar shapes for the two profiles, consistent with a linear relationship between mass and light both within and outside the void radius. We validate our analysis with the help of simulated mock catalogues and estimate the impact of photometric redshift uncertainties on the measurement. Our methodology can be used for cosmological applications, including tests of gravity with voids. Finally, this is especially promising when the lensing profiles are combined with spectroscopic measurements of void dynamics via redshift-space distortions.

79 ASTRONOMY AND ASTROPHYSICS↗

RAIS Paducah Background Values

The Paducah Background Values (https://rais.ornl.gov/tools/pgdp_background.html) are from Methods for Conducting Risk Assessments and Risk Evaluations at the Paducah Gaseous Diffusion Plant, Volume 1, Human Health, which sought to establish provisional background values for groundwater and soil. These values were developed by considering agreements reached between the DOE and the regulatory agencies during comment resolution meetings, in the Federal Facility Agreement, and at technical meetings. The Paducah background concentrations are available for soil (surface and subsurface) and groundwater (filtered and unfiltered).

Dolislager, Fred [Oak Ridge National Laboratory (O↗

Ion Mobility Spectrometer Field Test

The Morpho Saffran Itemizer 4DX Ion Mobility Spectrometer previously used to detect uranium signatures in FY16 was used at the former New Brunswick Facility, a past uranium facility located on site at Argonne National Laboratory. This facility was chosen in an attempt to detect safeguards relevant signatures and has a history of processing uranium at various enrichments, chemical forms, and purities; various chemicals such as nitric acid, uranium fluorides, phosphates and metals are present at various levels. Several laboratories were sampled for signatures of nuclear activities around the laboratory. All of the surfaces that were surveyed were below background levels of the radioanalytical instrumentation and determined to be radiologically clean.

36 MATERIALS SCIENCE↗

Measuring the Radial Component of the Magnetic Field in the Muon g-2 Experiment

A leading systematic error in the muon electric dipole moment (EDM) analysis at Muon g-2 is the presence of radial magnetic fields because they cause indistinguishable effects to the muon spin precession plane from a true EDM measurement. Measuring a non-zero EDM would place a constraint in CP-violation, indicating new physics beyond the Standard Model. The radial field is composed of an applied radial field by the surface correction coils (SCC) and a background radial field due to imperfections in the materials and alignment of magnetic elements. We determine an optimal SCC setting that best minimizes the background radial field by performing a scan at different electro-static quadrupole settings and studying its relation with the vertical beam position and applied radial field. In this talk I will present our results and describe our efforts to design an apparatus outfitted with Hall probes and tilt sensors to directly measure the radial magnetic field as a function of az imuth.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Radiological Assessment for the Removal of Legacy BPA Power Lines that Cross the Hanford Site

This paper discusses some radiological field monitoring and assessment methods used to assess the components of an old electrical power transmission line that ran across the Hanford Site between the production reactors area (100 Area) and the chemical processing area (200 Area). This task was complicated by the presence of radon daughters -- both beta and alpha emitters -- residing on the surfaces, particularly on the surfaces of weathered metals and metals that had been electrically-charged. In many cases, these activities were high compared to the DOE Surface Contamination Guidelines, which were used as guides for the assessment. These methods included the use of the Toulmin model of argument, represented using Toulmin diagrams, to represent the combined force of several strands of evidences, rather than a single measurement of activity, to demonstrate beyond a reasonable doubt that no or very little Hanford activity was present and mixed with the natural activity. A number of forms of evidence were used: the overall chance of Hanford contamination; measurements of removable activity, beta and alpha; 1-minute scaler counts of total surface activity, beta and alpha, using "background makers"; the beta activity to alpha activity ratios; measured contamination on nearby components; NaI gamma spectral measurements to compare uncontaminated and potentially-contaminated spectra, as well as measurements for the sentinel radionuclides, Am- 241 and Cs-137 on conducting wire; comparative statistical analyses; and in-situ measurements of alpha spectra on conducting wire showing that the alpha activity was natural Po-210, as well as to compare uncontaminated and potentially-contaminated spectra.

24 POWER TRANSMISSION AND DISTRIBUTION↗

HDG-2 & VIC Design Updates

HDG-2 and VIC Design updates. Including background, HDG-1 challenges, HDG-2 Mitigation efforts, Effect of updated ring model, Pressure boundary surface finish, and conclusions. Vendor Irradiation Capsule (VIC) to include, background, design overview, testing and neutronics results, and models.

11 - NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Computational Assessment of Naturally Occurring Neutron and Photon Background Radiation Produced by Extraterrestrial Sources

In this study, a computational assessment of the variation in terrestrial neutron and photon background from extraterrestrial sources is presented. The motivation of this assessment is to evaluate the practicality of developing a tool or database to estimate background in real time (or near–real time) during an experimental measurement or to even predict the background for future measurements. The extraterrestrial source focused on during this assessment is naturally occurring galactic cosmic rays (GCRs). The MCNP6 transport code was used to perform the computational assessment. However, the GCR source available in MCNP6 was not used. Rather, models developed and maintained by NASA were used to generate the GCR sources. The largest variation in both neutron and photon background spectra was found to be caused by changes in elevation on Earth's surface, which can be as large as an order of magnitude. All other perturbations produced background variations on the order of a factor of 3 or less. The most interesting finding was that ~80% and 50% of terrestrial background neutrons and photons, respectively, are generated by interactions in Earth's surface and other naturally occurring and man-made objects near a detector of particles from extraterrestrial sources and their progeny created in Earth's atmosphere. In conclusion, this assessment shows that it will be difficult to estimate the terrestrial background from extraterrestrial sources without a good understanding of a detector's surroundings. Therefore, estimating or predicting background during a measurement environment like a mobile random search will be difficult.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

EFFECTS OF DIFFUSE BACKGROUND EMISSION AND SOURCE CROWDING ON PHOTOMETRIC COMPLETENESS IN SPITZER SPACE TELESCOPE IRAC SURVEYS: THE GLIMPSE CATALOGS AND ARCHIVES

We characterize the completeness of point source lists from Spitzer Space Telescope surveys in the four Infrared Array Camera (IRAC) bandpasses, emphasizing the Galactic Legacy Infrared Mid-Plane Survey Extraordinaire (GLIMPSE) programs (GLIMPSE I, II, 3D, 360; Deep GLIMPSE) and their resulting point source Catalogs and Archives. The analysis separately addresses effects of incompleteness resulting from high diffuse background emission and incompleteness resulting from point source confusion (i.e., crowding). An artificial star addition and extraction analysis demonstrates that completeness is strongly dependent on local background brightness and structure, with high-surface-brightness regions suffering up to five magnitudes of reduced sensitivity to point sources. This effect is most pronounced at the IRAC 5.8 and 8.0 {mu}m bands where UV-excited polycyclic aromatic hydrocarbon emission produces bright, complex structures (photodissociation regions). With regard to diffuse background effects, we provide the completeness as a function of stellar magnitude and diffuse background level in graphical and tabular formats. These data are suitable for estimating completeness in the low-source-density limit in any of the four IRAC bands in GLIMPSE Catalogs and Archives and some other Spitzer IRAC programs that employ similar observational strategies and are processed by the GLIMPSE pipeline. By performing the same analysis on smoothed images we show that the point source incompleteness is primarily a consequence of structure in the diffuse background emission rather than photon noise. With regard to source confusion in the high-source-density regions of the Galactic Plane, we provide figures illustrating the 90% completeness levels as a function of point source density at each band. We caution that completeness of the GLIMPSE 360/Deep GLIMPSE Catalogs is suppressed relative to the corresponding Archives as a consequence of rejecting stars that lie in the point-spread function wings of saturated sources. This effect is minor in regions of low saturated star density, such as toward the Outer Galaxy; this effect is significant along sightlines having a high density of saturated sources, especially for Deep GLIMPSE and other programs observing closer to the Galactic center using 12 s or longer exposure times.

79 ASTRONOMY AND ASTROPHYSICS↗

Atomic oxygen density determination in the effluent of the COST reference source using in situ effective lifetime measurements in the presence of a liquid interface

Abstract Spatially resolved, absolute densities of atomic oxygen are measured for several helium-based admixtures in the effluent of the COST Reference Microplasma Jet using two-photon absorption laser induced fluorescence (TALIF). Admixtures investigated include a helium-only admixture, four helium/oxygen admixtures (0.1 % , 0.5 % , 0.6 % , and 1.0 % oxygen), and a helium/water admixture (2500 ppm water), chosen to coincide with previously published characterizations of plasma-treated liquid. The atomic oxygen TALIF signal is calibrated for density using the noble gas xenon, which possesses a very similar two-photon excitation and fluorescence scheme. Measurements are conducted for the jet operating in ambient air with both an open effluent and a liquid surface present, allowing for comparison with liquid phase measurements conducted under similar conditions. The presence of a water surface does not appear to alter the background chemistry in the effluent but reduces O densities close to the liquid interface when compared to a similar distance from the nozzle in an open effluent case. This may be the result of a reduction in flow velocity caused by the liquid obstructing the gas flow. Additionally, measurements near the liquid surface revealed a region of atomic oxygen well outside of where the core of the effluent impinges on the liquid. This is likely relevant for applications as it considerably expands the surface area subject to O absorption. Critically, in situ measurements of the effective lifetimes of the laser-excited 3p 3 P J state of atomic oxygen were recorded in the effluent by employing a picosecond (ps) laser and a nanosecond (ns) ICCD. By experimentally determining the contribution from collisional quenching via the in situ effective lifetime measurements, significant improvements in the accuracy of the atomic oxygen density calibration were made, with differences of approximately 30 % from existing methods of estimating quenching rates at atmospheric pressure. Finally, spatially resolved atomic oxygen densities allow for an investigation of O formation and extinction pathways in the effluent and a comparison between admixtures.

laser diagnostics↗