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At least 1,531 records · Page 85

Hydrogen Localization and Cluster Formation in α-Zr from First-Principles Investigations

We report alpha-zirconium (α-Zr) is a hydrogen atom host material used in nuclear energy and semiconducting applications due to Zr's excellent properties such as corrosion resistance, low thermal neutrons cross-section, and thermodynamically favorable interstitial sequestering of H atoms. Herein we use density functional theory simulations to systematically analyze the initial stages of H insertion in the Zr matrix, and determine optimal hydrogen localization, distribution, and clustering tendencies from a thermodynamics and kinetics perspective. Our results suggest that H occupation of tetrahedral sites is strongly favored, consistent with previous experimental and theoretical studies. Further, a cooperative effect in H localization is shown where H atoms favor clustering. The H pair is found to be the most stable by occupying tetrahedral sites with pairs at second nearest-neighbor positions (TTn2). Among the four H atom clusters, the most favorable configuration has two TTn2 pairs forming "box " or "zig-zag" shaped-cluster with the pairs separated by 3.03 or 3.25 Å, respectively. Nudged elastic band simulations suggest that the formation of TTn2 is facile and is limited by the small diffusion barrier of the monomer of less than 0.1 eV. Further, the formation routes for the 4H atom clusters are also presented. The current study can serve as a foundation to systematically model H atom clustering in metals and alloys.

36 MATERIALS SCIENCE↗

Energy performance evaluation of the ASHRAE Guideline 36 control and reinforcement learning–based control using field measurements

This study evaluates the energy performance of ASHRAE Guideline 36–compliant control (ASHRAE 36 control) and reinforcement learning (RL)–based control through experimental field tests and a simulation study. Three field tests were conducted at Oak Ridge National Laboratory’s commercial building test facility in Oak Ridge, Tennessee: a baseline with a baseline conventional control, a test with ASHRAE 36 control, and a test with RL-based control. The selected ASHRAE 36 controls were trim and respond control, as well as variable air volume (VAV) box control. We compared the measured supply air temperature of the rooftop unit, VAV box supply air temperature, and VAV box supply airflow rate across the three test cases. The field data indicated that ASHRAE 36 controls operated as specified by ASHRAE Guideline 36. Based on these data, ASHRAE 36 control achieved a 45 % reduction in hourly averaged HVAC energy consumption compared with the baseline, and RL-based control achieved a 66 % reduction. These potential annual energy savings were confirmed using a calibrated whole-building energy model. Compared with the baseline, ASHRAE 36 control reduced HVAC energy consumption by 42 %, and RL-based control achieved a 54 % reduction. Furthermore, RL-based control reduced total HVAC energy consumption by 21 % more than ASHRAE 36 control.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

Dynamic testing of a two-dimensional box truss beam

Testing to determine the effects of joint freeplay and pretensioning of diagonal members on the dynamic characteristics of a two-dimensional box truss beam was conducted. The test article was ten bays of planar truss suspended by long wires at each joint. Each bay measured 2 meters per side. Pins of varying size were used to simulate various joint freeplay conditions. Single-point random excitation was the primary method of test. The rational fraction polynomial method was used to extract modal characteristics from test data. A finite element model of the test article was generated from which modal characteristics were predicted. These were compared with those obtained from tests. With the exception of the fundamental mode, correlation of theoretical and experimental results was poor, caused by the resonant coupling of local truss member bending modes with global truss beam modes. This coupling introduced many modes in the frequency range of interest whose frequencies were sensitive to joint boundary conditions. It was concluded that local/global coupling must be avoided in the frequency range where accurate modal characteristics are required.

White, Charles W.↗

Progress in the prediction of unsteady heat transfer on turbines blades

Progress toward developing a general method for predicting unsteady heat transfer on turbine blades subject to blade-passing frequencies and Reynolds numbers relevant to the Space Shuttle Main Engine (SSME) is discussed. The method employs an invisid/viscous interactive procedure which has been tested extensively for steady subsonic and transonic external airfoil problems. One such example is shown. The agreement with experimental data and with Navier-Stokes calculations yields confidence in the method. The technique is extended to account for wake generated unsteadiness. The flow reversals around the stagnation point caused by the nonuniform onset velocity are accounted for by using the Characteristic Box scheme developed by Cebeci and Stewartson. The coupling between the inviscid and viscous methods is achieved by using a special procedure, which, with a novel inverse finite-difference boundary-layer method, allows the calculations to be performed for a wide range of flow conditions, including separation. Preliminary results are presented for the stagnation region of turbine blades for both laminar and turbulent flows. A laminar model problem corresponding to a flow on a circular cylinder which experiences the periodic passing of wakes from turbine blades is presented to demonstrate the ability of the method to calculate flow reversals around the stagnation region.

Cebeci, T.↗

Global-Local Analysis and Optimization of a Composite Civil Tilt-Rotor Wing

This report gives highlights of an investigation on the design and optimization of a thin composite wing box structure for a civil tilt-rotor aircraft. Two different concepts are considered for the cantilever wing: (a) a thin monolithic skin design, and (b) a thick sandwich skin design. Each concept is examined with three different skin ply patterns based on various combinations of 0, +/-45, and 90 degree plies. The global-local technique is used in the analysis and optimization of the six design models. The global analysis is based on a finite element model of the wing-pylon configuration while the local analysis uses a uniformly supported plate representing a wing panel. Design allowables include those on vibration frequencies, panel buckling, and material strength. The design optimization problem is formulated as one of minimizing the structural weight subject to strength, stiffness, and d,vnamic constraints. Six different loading conditions based on three different flight modes are considered in the design optimization. The results of this investigation reveal that of all the loading conditions the one corresponding to the rolling pull-out in the airplane mode is the most stringent. Also the frequency constraints are found to drive the skin thickness limits, rendering the buckling constraints inactive. The optimum skin ply pattern for the monolithic skin concept is found to be (((0/+/-45/90/(0/90)(sub 2))(sub s))(sub s), while for the sandwich skin concept the optimal ply pattern is found to be ((0/+/-45/90)(sub 2s))(sub s).

Rais-Rohani, Masound↗

Venus Mobile Explorer with RPS for Active Cooling: A Feasibility Study

We present our findings from a study to evaluate the feasibility of a radioisotope power system (RPS) combined with active cooling to enable a long-duration Venus surface mission. On-board power with active cooling technology featured prominently in both the National Research Council's Decadal Survey and in the 2006 NASA Solar System Exploration Roadmap as mission-enabling for the exploration of Venus. Power and cooling system options were reviewed and the most promising concepts modeled to develop an assessment tool for Venus mission planners considering a variety of future potential missions to Venus, including a Venus Mobile Explorer (either a balloon or rover concept), a long-lived Venus static lander, or a Venus Geophysical Network. The concepts modeled were based on the integration of General Purpose Heat Source (GPHS) modules with different types of Stirling cycle heat engines for power and cooling. Unlike prior investigations which reported on single point design concepts, this assessment tool allows the user to generate either a point design or parametric curves of approximate power and cooling system mass, power level, and number of GPHS modules needed for a "black box" payload housed in a spherical pressure vessel.

Leifer, Stephanie D.↗

Metabolic Engineering and Modeling of Metabolic Pathways to Improve Hydrogen Production by Photosynthetic Bacteria

Rising energy demands and the imperative to reduce carbon dioxide (CO 2 ) emissions are driving research on biofuels development. Hydrogen gas (H 2 ) is one of the most promising biofuels and is seen as a future energy carrier by virtue of the fact that 1) it is renewable, 2) does not evolve the “greenhouse gas” CO 2 in combustion, 3) liberates large amounts of energy per unit weight in combustion (having about 3 times the energy content of gasoline), and 4) is easily converted to electricity by fuel cells. Among the various bioenergy strategies, environmental groups and others say that the concept of the direct manufacture of alternative fuels, such as H 2 , by photosynthetic organisms is the only biofuel alternative without significant negative criticism [1]. Biological H 2 production by photosynthetic microorganisms requires the use of a simple solar reactor such as a transparent closed box, with low energy requirements, and is considered as an attractive system to develop as a biocatalyst for H 2 production [2]. Various purple bacteria including Rhodopseudomonas palustris, can utilize organic substrates as electron donors to produce H 2 at the expense of solar energy. Because of the elimination of energy cost used for H 2 O oxidation and the prevention of the production of O 2 that inhibits the H 2 -producing enzymes, the efficiency of light energy conversion to H 2 by anoxygenic photosynthetic bacteria is in principle much higher than that by green algae or cyanobacteria, and is regarded as one of the most promising cultures for biological H 2 production [3]. Here implemented a simple and relatively straightforward strategy for hydrogen production by photosynthetic microorganisms using sunlight, sulfur- or iron-based inorganic substrates, and CO 2 as the feedstock. Carefully selected microorganisms with bioengineered beneficial traits act as the biocatalysts of the process designed to both enhance the system efficiency of CO 2 fixation and the net hydrogen production rate. Additionally we applied metabolic engineering approaches guided by computational modeling for the chosen model microorganisms to enable efficient hydrogen production.

59 BASIC BIOLOGICAL SCIENCES↗

Global simulations of protoplanetary disks with OHMIC resistivity and ambipolar diffusion

Protoplanetary disks (PPDs) are believed to accrete onto their central T Tauri star because of magnetic stresses. Recently published shearing box simulations indicate that Ohmic resistivity, ambipolar diffusion (AD) and the Hall effect all play important roles in disk evolution. In the presence of a vertical magnetic field, the disk remains laminar between 1–5 AU, and a magnetocentrifugal disk wind forms that provides an important mechanism for removing angular momentum. Questions remain, however, about the establishment of a true physical wind solution in the shearing box simulations because of the symmetries inherent in the local approximation. We present global MHD simulations of PPDs that include Ohmic resistivity and AD, where the time-dependent gas-phase electron and ion fractions are computed under FUV and X-ray ionization with a simplified recombination chemistry. Our results show that the disk remains laminar, and that a physical wind solution arises naturally in global disk models. The wind is sufficiently efficient to explain the observed accretion rates. Furthermore, the ionization fraction at intermediate disk heights is large enough for magneto-rotational channel modes to grow and subsequently develop into belts of horizontal field. Depending on the ionization fraction, these can remain quasi-global, or break-up into discrete islands of coherent field polarity. The disk models we present here show a dramatic departure from our earlier models including Ohmic resistivity only. It will be important to examine how the Hall effect modifies the evolution, and to explore the influence this has on the observational appearance of such systems, and on planet formation and migration.

79 ASTRONOMY AND ASTROPHYSICS↗

Neutrino masses and cosmology with Lyman-alpha forest power spectrum

We present constraints on neutrino masses, the primordial fluctuation spectrum from inflation, and other parameters of the ΛCDM model, using the one-dimensional Lyα-forest power spectrum measured by [1] from the Baryon Oscillation Spectroscopic Survey (BOSS) of the Sloan Digital Sky Survey (SDSS-III), complemented by Planck 2015 cosmic microwave background (CMB) data and other cosmological probes. This paper improves on the previous analysis by [2] by using a more powerful set of calibrating hydrodynamical simulations that reduces uncertainties associated with resolution and box size, by adopting a more flexible set of nuisance parameters for describing the evolution of the intergalactic medium, by including additional freedom to account for systematic uncertainties, and by using Planck 2015 constraints in place of Planck 2013. Fitting Lyα data alone leads to cosmological parameters in excellent agreement with the values derived independently from CMB data, except for a weak tension on the scalar index n{sub s}. Combining BOSS Lyα with Planck CMB constrains the sum of neutrino masses to ∑ m{sub ν} < 0.12 eV (95% C.L.) including all identified systematic uncertainties, tighter than our previous limit (0.15 eV) and more robust. Adding Lyα data to CMB data reduces the uncertainties on the optical depth to reionization τ, through the correlation of τ with σ{sub 8}. Similarly, correlations between cosmological parameters help in constraining the tensor-to-scalar ratio of primordial fluctuations r. The tension on n{sub s} can be accommodated by allowing for a running dn{sub s}/d ln k. Allowing running as a free parameter in the fits does not change the limit on ∑ m{sub ν}. We discuss possible interpretations of these results in the context of slow-roll inflation.

79 ASTRONOMY AND ASTROPHYSICS↗

Adaptive resource allocation for surrogate modeling of systems comprised of multiple disciplines with varying fidelity

We present an adaptive algorithm for constructing surrogate models for integrated systems composed of a set of coupled components. With this goal we introduce ‘coupling’ variables with a priori unknown distributions that allow approximations of each component to be built independently. Once built, the surrogates of the components are combined and used to predict system-level quantities of interest (QoI) at a fraction of the cost of interrogating the full system model. We use a greedy experimental design procedure, based upon a modification of Multi-Index Stochastic Collocation (MISC), to minimize the error of the combined surrogate. This is achieved by refining each component surrogate in accordance with its relative contribution to error in the approximation of the system-level QoI. Our adaptation of MISC is a multi-fidelity procedure that can leverage ensembles of models of varying cost and accuracy, for one or more components, to produce estimates of system-level QoI. Several numerical examples demonstrate the efficacy of the proposed approach on systems involving feed-forward and feedback coupling. For a fixed computational budget, the proposed algorithm is able to produce approximations that are orders of magnitude more accurate than approximations that treat the integrated system as a black-box.

97 MATHEMATICS AND COMPUTING↗

Uncertainty Quantification for Quantitative Imaging Holdup Measurements

In nuclear fuel cycle safeguards, special nuclear material "held up" in pipes, ducts, and glove boxes causes significant uncertainty in material-unaccounted-for estimates. Quantitative imaging is a proposed non-destructive assay technique with potential to estimate the holdup mass more accurately and reliably than current techniques. However, uncertainty analysis for quantitative imaging remains a significant challenge. In this work we demonstrate an analysis approach for data acquired with a fast-neutron coded aperture imager. The work includes a calibrated forward model of the imager. Cross-validation indicates that the forward model predicts the imager data typically within 23%; further improvements are forthcoming. A new algorithm based on the chi-squared goodness-of-fit metric then uses the forward model to calculate a holdup confidence interval. The new algorithm removes geometry approximations that previous methods require, making it a more reliable uncertainty estimator.

holdup measurement↗

Zingerone reduces HMGB1-mediated septic responses and improves survival in septic mice

High mobility group box 1 (HMGB1) is considered a late mediator of sepsis and the inhibition of HMGB1-mediated severe inflammatory responses and restoration of endothelial integrity have emerged as attractive therapeutic strategies for the management of sepsis. Zingerone (ZGR), a phenolic alkanone isolated from ginger, has been reported to possess various pharmacological activities. We examined the effects of ZGR on HMGB1-mediated septic responses and survival rate in a mouse model of sepsis. ZGR was administered after HMGB1 challenge. The antiseptic activity of ZGR was determined from the measurements of permeability, leukocyte adhesion and migration, activation of pro-inflammatory proteins, and the production of tissue injury markers in HMGB1-activated HUVECs and mice. ZGR significantly reduced HMGB1 release in LPS-activated HUVECs via the SIRT1-mediated deacetylation of HMGB1. And, ZGR suppressed the production of TNF-α and IL-6 and the activation of NF-κB and ERK 1/2 by HMGB1. ZGR also inhibited HMGB1-mediated hyperpermeability and leukocyte migration in mice. In addition, treatment with ZGR reduced the CLP-induced release of HMGB1, sepsis-related mortality, and tissue injury in vivo. Our results indicated that ZGR might be useful in the treatment of sepsis by targeting HMGB1. - Highlights: • HMGB1 is considered a late mediator of sepsis. • Zingerone suppressed LPS-induced secretion of HMGB1 in vitro and in vivo. • Zingerone reduced HMGB1-mediated hyperpermeability in vitro and in vivo. • Zingerone inhibited HMGB1-mediated leukocytes adhesion and migration. • Zingerone reduced mortality and lung injury in mouse sepsis model.

60 APPLIED LIFE SCIENCES↗

Measuring Hydroxylammonium, Nitrate, and Nitrite Concentration with Raman Spectroscopy for 238 Pu Supply Program

Optical spectroscopy has great potential to improve the timeliness of important analytical measurements for the 238 Pu Supply Program by enabling real-time analysis of process solutions within radiochemical hot cells. Hydroxylammonium (H 3 NOH + ]), nitrate (NO 3 - ), and nitrite (NO 2 - ) are three important molecular species present in multiple aqueous streams throughout the program’s flow sheet. The concentration of each species normally goes uncharacterized during processing. However, rapid quantification may benefit the program because uncertainties in kinetic redox expressions describing hydroxylammonium (HA) and nitrite reactions with Np and Pu leads to uncertainty in process model predictions for solvent extraction runs. HA concentration is normally quantified using ion chromatography, a technique that requires diluted grab samples taken out of the hot cell and analyzed off-line. Here we evaluate Raman spectroscopy for determining the concentration of H 3 NOH + , NO 3 - , and NO 2 - in benchtop tests to determine limits of detection. We also consider the possibility of using Raman spectroscopy in both glove box and hot cell environments for rapid analysis and pinpoint additional development opportunities needed to make this application successful.

38 RADIATION CHEMISTRY, RADIOCHEMISTRY, AND NUCLEA↗

The Discovery of the Electromagnetic Counterpart of GW170817: Kilonova AT 2017gfo/DLT17ck

During the second observing run of the Laser Interferometer Gravitational-wave Observatory (LIGO) and Virgo Interferometer, a gravitational-wave signal consistent with a binary neutron star coalescence was detected on 2017 August 17th (GW170817), quickly followed by a coincident short gamma-ray burst trigger detected by the Fermi satellite. The Distance Less Than 40 (DLT40) Mpc supernova search performed pointed follow-up observations of a sample of galaxies regularly monitored by the survey that fell within the combined LIGO+Virgo localization region and the larger Fermi gamma-ray burst error box. Here we report the discovery of a new optical transient (DLT17ck, also known as SSS17a; it has also been registered as AT 2017gfo) spatially and temporally coincident with GW170817. The photometric and spectroscopic evolution of DLT17ck is unique, with an absolute peak magnitude of M {sub r} = −15.8 ± 0.1 and an r -band decline rate of 1.1 mag day{sup −1}. This fast evolution is generically consistent with kilonova models, which have been predicted as the optical counterpart to binary neutron star coalescences. Analysis of archival DLT40 data does not show any sign of transient activity at the location of DLT17ck down to r ∼ 19 mag in the time period between 8 months and 21 days prior to GW170817. This discovery represents the beginning of a new era for multi-messenger astronomy, opening a new path by which to study and understand binary neutron star coalescences, short gamma-ray bursts, and their optical counterparts.

79 ASTRONOMY AND ASTROPHYSICS↗

An ultrasoft X-ray source in Coma Berenices

An intense soft X-ray source with an extraordinary spectrum has been observed in Coma Berenices, 4 deg northeast of and not associated with the Coma cluster of galaxies. Two spectra, obtained at different times in a sounding-rocket flight, indicate that the source temperature in thermal models is less than 1 million K; a power-law model requires photon power-law indices steeper than n = -3. The intensity in the 44-165 A band is of the order of 5 by 10 to the -10th power erg/sq cm/sec, but no flux is present at energies 0.3-2.1 keV to a limit of 1 by 10 to the -10th power erg/sq cm/sec. The lack of bright stars or a supernova remnant in the error box implies that this may be a new class of soft X-ray sources.

Margon, B.↗

Measured and predicted structural behavior of the HiMAT tailored composite wing

A series of load tests was conducted on the HiMAT tailored composite wing. Coupon tests were also run on a series of unbalanced laminates, including the ply configuration of the wing, the purpose of which was to compare the measured and predicted behavior of unbalanced laminates, including - in the case of the wing - a comparison between the behavior of the full scale structure and coupon tests. Both linear and nonlinear finite element (NASTRAN) analyses were carried out on the wing. Both linear and nonlinear point-stress analyses were performed on the coupons. All test articles were instrumented with strain gages, and wing deflections measured. The leading and trailing edges were found to have no effect on the response of the wing to applied loads. A decrease in the stiffness of the wing box was evident over the 27-test program. The measured load-strain behavior of the wing was found to be linear, in contrast to coupon tests of the same laminate, which were nonlinear. A linear NASTRAN analysis of the wing generally correlated more favorably with measurements than did a nonlinear analysis. An examination of the predicted deflections in the wing root region revealed an anomalous behavior of the structural model that cannot be explained. Both hysteresis and creep appear to be less significant in the wing tests than in the corresponding laminate coupon tests.

Nelson, Lawrence H.↗

Wing design for a civil tiltrotor transport aircraft: A preliminary study

A preliminary study was conducted on the design of the wing-box structure for a civil tiltrotor transport aircraft. The wing structural weight is to be minimized subject to structural and aeroelastic constraints. The composite wing-box structure is composed of skin, stringers, ribs, and spars. The design variables include skin ply thicknesses and orientations and spar cap and stringer cross-sectional areas. With the total task defined, an initial study was conducted to learn more about the intricate dynamic and aeroelastic characteristics of the tiltrotor aircraft and their roles in the wing design. Also, some work was done on the wing finite-element modeling (via PATRAN) which would be used in structural analysis and optimization. Initial studies indicate that in order to limit the wing/rotor aeroelastic and dynamic interactions in the preliminary design, the cruise speed, rotor system, and wing geometric attributes must all be held fixed.

Rais-Rohani, Masoud↗

Mercury Conditions for the MESSENGER Mission Simulated in High- Solar-Radiation Vacuum Tests

The MESSENGER (Mercury Surface, Space Environment, Geochemistry, and Ranging) spacecraft, planned for launch in March 2004, will perform two flybys of Mercury before entering a year-long orbit of the planet in September 2009. The mission will provide opportunities for detailed characterization of the surface, interior, atmosphere, and magnetosphere of the closest planet to the Sun. The NASA Glenn Research Center and the MESSENGER spacecraft integrator, the Johns Hopkins University Applied Physics Laboratory, have partnered under a Space Act Agreement to characterize a variety of critical components and materials under simulated conditions expected near Mercury. Glenn's Vacuum Facility 6, which is equipped with a solar simulator, can simulate the vacuum and high solar radiation anticipated in Mercury orbit. The MESSENGER test hardware includes a variety of materials and components that are being characterized during the Tank 6 vacuum tests, where the hardware will be exposed to up to 11 suns insolation, simulating conditions expected in Mercury orbit. In 2002, ten solar vacuum tests were conducted, including beginning of life, end of life, backside exposure, and solar panel thermal shock cycling tests. Components tested include candidate solar array panels, sensors, thermal shielding materials, and communication devices. As an example, for the solar panel thermal shock cycling test, two candidate solar array panels were suspended on a lift mechanism that lowered the panels into a liquid-nitrogen-cooled box. After reaching -140 C, the panels were then lifted out of the box and exposed to the equivalent of 6 suns (8.1 kilowatts per square meters). After five cold soak/heating cycles were completed successfully, there was no apparent degradation in panel performance. An anticipated 100-hr thermal shield life test is planned for autumn, followed by solar panel flight qualification tests in winter. Glenn's ongoing support to the MESSENGER program has been instrumental in identifying design solutions and validating thermal performance models under a very aggressive development schedule. The test data have assisted Johns Hopkins engineers in selecting a flight solar array vendor and a thermal shield design. MESSENGER is one in a series of missions in NASA's Discovery Program. Infrared thermography provides data on the thermal gradients in the MESSENGER components during high solar insolation vacuum testing.

Wong, Wayne A.↗