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At least 1,639 records · Page 91

Aqueous ion partitioning in Nafion: Applicability of Manning's counter-ion condensation theory

Nafion is a well-studied polymer of significant interest as a fuel cell membrane due to rapid transport of protons, which is often ascribed, at least in part, to its phase-separated morphology. The literature detailing ion sorption and transport in Nafion diverges considerably from that of water purification membranes, with contrasting analyses and models. To help bridge these gaps and facilitate comparisons of membranes with various structures, this study presents measurements of ion activity coefficients and sorption in Nafion 117 equilibrated with aqueous solutions of NaCl, MgCl 2 , and Na 2 SO 4 , which are relevant to water purification. The experimental data are compared to a theoretical framework based on Manning's counter-ion condensation theory and Donnan theory. Good agreement between the model and data is observed for NaCl and MgCl 2 , using no adjustable parameters. However, the model significantly underpredicts Na 2 SO 4 solubility, which is attributed to ion pairing effects. Furthermore, the results highlight the general applicability of counter-ion condensation theory to highly charged polymers, including those exhibiting nanoscale ordering, while revealing fundamental limitations related to ion pairing.

36 MATERIALS SCIENCE↗

Dispersion Validation for Flow Involving a Large Structure Revisited: 45 Degree Rotation

The atmospheric dispersion of contaminants in the wake of a large urban structure is a challenging fluid mechanics problem of interest to the scientific and engineering communities. Magnetic Resonance Velocimetry (MRV) and Magnetic Resonance Concentration (MRC) are relatively new techniques that leverage diagnostic equipment used primarily by the medical field to make 3D engineering measurements of flow and contaminant dispersal. SIERRA/Fuego, a computational fluid dynamics (CFD) code at Sandia National Labs is employed to make detailed comparisons to the dataset to evaluate the quantitative and qualitative accuracy of the model. This work is the second in a series of scenarios. In the prior work, a single large building in an array of similar buildings was considered with the wind perpendicular to a building face. In this work, the geometry is rotated by 45 degrees and improved studies are performed for simulation credibility. The comparison exercise shows conditionally good comparisons between the model and experiment. Model uncertainties are assessed through parametric variations. Various methods of quantifying the accuracy between experiments and data are examined Three-dimensional analysis of accuracy is performed. The effort helped identify deficiencies in the techniques used to make these comparisons, and further methods development therefore becomes one of the main recommendations for follow-on work.

42 ENGINEERING↗

Smythii basin topography and comparisons with Orientale

The Smythii basin has the most extensive topographic coverage of any lunar multi-ringed basin. Topographic data are used to study the morphology and morphometry of Smythii and to make comparisons with similar basins. The depth of the basin is shown to be over 8 km, which is comparable to that of Orientale. The inner ring reaches heights of 3.4 km, while the intermediate ring exhibits little relief. Lowest points in the basin are related to mare ridges. Basin volume is estimated to be 21 million cubic kilometers. Evidence suggests that significant differences in substrate characteristics may have existed for the Smythii and Orientale impacts.

Strain, P. L.↗

Mapping Planetary Volcanic Deposits: Identifying Vents and Distinguishing between Effects of Eruption Conditions and Local Storage and Release on Flow Field Morphology

Terrestrial geologic mapping techniques are regularly used for "photogeologic" mapping of other planets, but these approaches are complicated by the diverse type, areal coverage, and spatial resolution of available data sets. When available, spatially-limited in-situ human and/or robotic surface observations can sometimes introduce a level of detail that is difficult to integrate with regional or global interpretations. To assess best practices for utilizing observations acquired from orbit and on the surface, our team conducted a comparative study of geologic mapping and interpretation techniques. We compared maps generated for the same area in the San Francisco Volcanic Field (SFVF) in northern Arizona using 1) data collected for reconnaissance before and during the 2010 Desert Research And Technology Studies campaign, and 2) during a traditional, terrestrial field geology study. The operations, related results, and direct mapping comparisons are discussed in companion LPSC abstracts. Here we present new geologic interpretations for a volcanic cone and related lava flows as derived from all approaches involved in this study. Mapping results indicate a need for caution when interpreting past eruption conditions on other planetary surfaces from orbital data alone.

Bleacher, J. E.↗

A Comparison of Single-Cycle Versus Multiple-Cycle Proof Testing Strategies

Single-cycle and multiple-cycle proof testing (SCPT and MCPT) strategies for reusable aerospace propulsion system components are critically evaluated and compared from a rigorous elastic-plastic fracture mechanics perspective. Earlier MCPT studies are briefly reviewed. New J-integral estimation methods for semi-elliptical surface cracks and cracks at notches are derived and validated. Engineering methods are developed to characterize crack growth rates during elastic-plastic fatigue crack growth (FCG) and the tear-fatigue interaction near instability. Surface crack growth experiments are conducted with Inconel 718 to characterize tearing resistance, FCG under small-scale yielding and elastic-plastic conditions, and crack growth during simulated MCPT. Fractography and acoustic emission studies provide additional insight. The relative merits of SCPT and MCPT are directly compared using a probabilistic analysis linked with an elastic-plastic crack growth computer code. The conditional probability of failure in service is computed for a population of components that have survived a previous proof test, based on an assumed distribution of initial crack depths. Parameter studies investigate the influence of proof factor, tearing resistance, crack shape, initial crack depth distribution, and notches on the MCPT vs. SCPT comparison. The parameter studies provide a rational basis to formulate conclusions about the relative advantages and disadvantages of SCPT and MCPT. Practical engineering guidelines are proposed to help select the optimum proof test protocol in a given application.

McClung, R. C.↗

A Comparison of Single-Cycle Versus Multiple-Cycle Proof Testing Strategies

Single-cycle and multiple-cycle proof testing (SCPT and MCPT) strategies for reusable aerospace propulsion system components are critically evaluated and compared from a rigorous elastic-plastic fracture mechanics perspective. Earlier MCPT studies are briefly reviewed. New J-integral estimation methods for semi-elliptical surface cracks and cracks at notches are derived and validated. Engineering methods are developed to characterize crack growth rates during elastic-plastic fatigue crack growth (FCG) and the tear-fatigue interaction near instability. Surface crack growth experiments are conducted with Inconel 718 to characterize tearing resistance, FCG under small-scale yielding and elastic-plastic conditions, and crack growth during simulated MCPT. Fractography and acoustic emission studies provide additional insight. The relative merits of SCPT and MCPT are directly compared using a probabilistic analysis linked with an elastic-plastic crack growth computer code. The conditional probability of failure in service is computed for a population of components that have survived a previous proof test, based on an assumed distribution of initial crack depths. Parameter studies investigate the influence of proof factor, tearing resistance, crack shape, initial crack depth distribution, and notches on the MCPT vs. SCPT comparison. The parameter studies provide a rational basis to formulate conclusions about the relative advantages and disadvantages of SCPT and MCPT. Practical engineering guidelines are proposed to help select the optimum proof test protocol in a given application.

McClung, R. C.↗

A Comparison of Single-Cycle Versus Multiple-Cycle Proof Testing Strategies

Single-cycle and multiple-cycle proof testing (SCPT and MCPT) strategies for reusable aerospace propulsion system components are critically evaluated and compared from a rigorous elastic-plastic fracture mechanics perspective. Earlier MCPT studies are briefly reviewed. New J-integral estimation methods for semielliptical surface cracks and cracks at notches are derived and validated. Engineering methods are developed to characterize crack growth rates during elastic-plastic fatigue crack growth (FCG) and the tear-fatigue interaction near instability. Surface crack growth experiments are conducted with Inconel 718 to characterize tearing resistance, FCG under small-scale yielding and elastic-plastic conditions, and crack growth during simulated MCPT. Fractography and acoustic emission studies provide additional insight. The relative merits of SCPT and MCPT are directly compared using a probabilistic analysis linked with an elastic-plastic crack growth computer code. The conditional probability of failure in service is computed for a population of components that have survived a previous proof test, based on an assumed distribution of initial crack depths. Parameter studies investigate the influence of proof factor, tearing resistance, crack shape, initial crack depth distribution, and notches on the MCPT versus SCPT comparison. The parameter studies provide a rational basis to formulate conclusions about the relative advantages and disadvantages of SCPT and MCPT. Practical engineering guidelines are proposed to help select the optimum proof test protocol in a given application.

McClung, R. C.↗

The Differential Cross Section and Λ Recoil Polarization from γδ -> Κ0(ρ)

Presented is the analysis of the differential cross section and Λ recoil polarization from the reaction γδ -> Κ0(ρ). This work measured these observables over beam energies from 0.90 GeV to 3.0 GeV. These measurements are the first in this channel to cover such a wide range of energies. The data were taken using the CEBAF Large Acceptance Spectrometer (CLAS) at Jefferson Laboratory (JLAB) along with a tagged photon beam. This analysis was completed by identifying events of interest that decayed into the final state topology of π-π+,π-&rho'(ρ). Through conservation of energy and momentum, the Κ0, Λ and missing mass of the spectator proton were reconstructed. Utilizing the same analysis techniques, the observables were measured on two different experiments with good agreement. Photoproduction of strange mesons from the neutron are difficult to measure, consequently there are only a few measurements of this kind. Despite that, these reactions supply essential complementary data to those on the proton. The differential cross sections and the recoil polarization extracted, span the region where new nucleon resonances have been found from studies of the reaction γρ -> Κ+Λ. Comparisons between the Κ+Λ and Κ0Λ cross section demonstrate that possible interference terms near 1900 MeV are less pronounced in the latter. This unexpected result inspired a partial wave analyses (PWA) to be fitted to the data. The fit solution shows that this measurement fostered an improvement on the knowledge of observed resonance parameters, necessary to understanding these excited states. The study of nucleon resonances is a key motivating factor since the resonance masses can be calculated from the theory of the strong nuclear force, called quantum chromodynamics, or QCD.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Substorm recurrence during steady and variable solar wind driving: Evidence for a normal mode in the unloading dynamics of the magnetosphere

Farrugia et al (1993) have recently studied substorm activity driven by the passage of an interplanetary magnetic cloud during which the interplanetary magnetic field turned southward for approximately 18 hours. It was shown that both the epsilon and the VB(sub s) parameters varied slowly on the timescale of a substorm but changed considerably over the interval as a whole. The substorm occurrence rate did not reflect the variation in magnetospheric energy loading rate as measured by these parameters but, rather, remained roughly constant with a 50-min average period. Klimas et al. (1992) showed that the Faraday loop analog model of geomagnetic activity predicts this single unloading rate under various constant loading rates. However, various model parameters were adjusted to yield a 1-hour unloading period in agreement with the Bargatze et al. (1985) linear prediction filters and in approximate agreement with the Farrugia et al. (1993) results. It has since been found necessary to add a slow relaxation mechanism to the Faraday loop model to allow for its approach to a ground state during long periods of inactivity. It is proposed that the relaxation mechanism is provided by slow convection of magnetic flux out of the magnetotail to the dayside magnetosphere. In addition, a rudimentary representation of magnetotail-ionosphere coupling has been added to enable comparison of model output to measured AL. The present study is of the modified Faraday loop model response to solar wind input from the Bargatze et al. data set with comparison of its output to concurrent AL. This study has removed the degree of freedom in parameter choice that had earlier allowed adjustments toward the 1-hour unloading period and has, instead, yielded the 1-hour unloading period under various constant loading rates. It is demonstrated that the second peak of the bimodal Bargatze et al. linear prediction filters at approximately equal 1-hour lag and the approximately constant substorm recurrence rate observed by Farrugia et al. can be interpreted as both being due to the existence of a normal unloading recurrence period in the dynamics of the magnetosphere.

Klimas, A. J.↗

Photon optimizer (PO) vs progressive resolution optimizer (PRO): a conformality- and complexity-based comparison for intensity-modulated arc therapy plans

This study aimed to provide guidance on the advantages and limitations of a new optimizer, “photon optimizer” (PO), when compared with its predecessor, “progressive resolution optimizer” (PRO), for intensity-modulated arc therapy (IMAT) plans. Eleven study plans that included a cohort of prostate, head and neck, and brain treatment sites were optimized using both PRO and PO algorithms. A plan template using the same objectives for the same number of iterations was used for each optimized plan to obtain hypothetical treatment plans that would be comparable with a clinical plan. Analysis was performed using plan conformity-based parameters such as target volume coverage factor, conformation number and homogeneity indices, and plan complexity assessment parameters such as small aperture score, modulation indices, and monitor unit variation with arc angle for prostate, brain and head, and neck IMAT treatment plans. Plan conformality analysis demonstrated that conformation numbers, target volume coverage factors, and homogeneity indices produced by the 2 optimizers were comparable for most anatomic sites. IMAT treatment plans produced using the PRO optimizer were found to be less complex than plans produced using the PO optimizer, in terms of multileaf collimator (MLC) leaf position variability and modulation complexity scores. Similarly, the PRO optimizer was shown to produce treatment plans that used fewer monitor units (and generally fewer monitor unit per degree of arc rotation) than PO optimizer. This study demonstrated that the PO optimizer can produce IMAT treatment plans with a similar degree of dose conformity to the target volume and generally improved organ at risk sparing, compared with the PRO optimizer. Better coverage to organs at risk produced by plans optimized using PO was observed to have higher MLC variability and monitor units. Therefore, careful evaluation of treatment plan conformity and complexity before assessing its deliverability is recommended when implementing the routine use of PO optimizer.

61 RADIATION PROTECTION AND DOSIMETRY↗

An evaluation of meteorological data prediction over Washington, D.C.: Comparison of DCNet observations and NAM model outputs

This study presents an example of how outputs of operational and readily-available mesoscale numerical models can be adapted to initialize dispersion calculations within the urban surface roughness layer. Three years of urban meteorological observations from central Washington, DC, are compared against forecast outputs of the North American Mesoscale (NAM) model. NAM wind speed predictions underestimate the observations in light winds and overestimate the measurements in high winds. Average wind directions are consistent. However, an adjustment of the predicted direction of the plume by –20° is needed. The uncertainty associated with this adjustment is large in light NAM wind speed with no evident variation by season. The values of the standard deviation of the wind direction, σθ derived from NAM model outputs underestimate the observations by a small amount (about –1.5 to –2.5°). The results presented here indicate that mesoscale numerical model outputs can provide information adequate for dispersion calculations. However, levels of uncertainty associated with implementation of the suggested procedures increase with decreasing wind speed, causing considerable uncertainty in the implementation of adjustments as low wind speed conditions are approached. Results and recommendations reported here should not be extended to other numerical models or other cities without further testing.

54 ENVIRONMENTAL SCIENCES↗

X-ray photoelectron spectroscopy of piperidinium ionic liquids: a comparison to the charge delocalised pyridinium analogues

In this study, nine piperidinium-based ionic liquids are analysed by X-ray photoelectron spectroscopy. The effect of alkyl substituent length and the nature of the anion on the electronic environment of the cation are investigated. The electronic environment of the hetero carbon and the cationic nitrogen is compared between two structurally similar cations, 1-octyl-1-methylpiperidinium ([C 8 C 1 Pip] + ) versus 1-octylpyridinium ([C 8 Py] + ). Due to the charge delocalisation, the hetero carbon component within [C 8 Py] + is more positively charged, which exhibits much higher binding energy; whilst the cationic nitrogen component is in the similar electronic environment. The impact of the charge delocalisation on the electronic environment of the anion is also compared between [C 8 C 1 Pip] + and [C 8 Py] + . Here, it is found that for the more basic anion, the cation can significantly affect the electronic environment of the anion; for the less basic anion, such an effect concentrates on the component bearing more negative point charges.

36 MATERIALS SCIENCE↗

High-Pressure Oxy-Syngas Ignition Delay Times With CO2 Dilution: Shock Tube Measurements and Comparison of the Performance of Kinetic Mechanisms

In this study, syngas combustion was investigated behind reflected shock waves in CO 2 bath gas to measure ignition delay times (IDT) and to probe the effects of CO 2 dilution. New syngas data were taken between pressures of 34.58–45.50 atm and temperatures of 1113–1275 K. This study provides experimental data for syngas combustion in CO 2 diluted environments: ignition studies in a shock tube (59 data points in 10 datasets). In total, these mixtures covered a range of temperatures T, pressures P, equivalence ratios φ , H 2 /CO ratio θ , and CO 2 diluent concentrations. Multiple syngas combustion mechanisms exist in the literature for modeling IDTs and their performance can be assessed against data collected here. In total, twelve mechanisms were tested and presented in this work. All mechanisms need improvements at higher pressures for accurately predicting the measured IDTs. At lower pressures, some of the models agreed relatively well with the data. Some mechanisms predicted IDTs which were two orders of magnitudes different from the measurements. This suggests that there is behavior that has not been fully understood on the kinetic models and is inaccurate in predicting CO 2 diluted environments for syngas combustion. To the best of our knowledge, current data are the first syngas IDTs measurements close to 50 atm under highly CO 2 diluted (85% per vol.) conditions.

Engineering↗

Comparison of State-Funded Technology Maturation Programs.

This study examines the structure and impact of state-funded technology maturation programs that leverage research institutions for economic development throughout the United States. The lessons learned and practices identified from previous experiences will inform Sandia National Laboratories' Government Relations and Technology Partnerships teams as they participate in near-term discussions about the proposed Technology Readiness Gross Receipts Tax Credit and Program, and continue to shape longer-term program and partnership opportunities. This Page Intentionally Left Blank

99 GENERAL AND MISCELLANEOUS↗

Review of drag measurements from flight tests of manned aircraft with comparisons to wind-tunnel predictions

In-flight studies of the overall and local components of drag of many types of aircraft were conducted. The primary goal of these studies was to evaluate wind-tunnel and semiempirical prediction methods. Some evaluations are presented in this paper which may be summarized by the following observations: Wind-tunnel predictions of overall vehicle drag can be accurately extrapolated to flight Reynolds numbers, provided that the base drag is removed and the boattail areas on the vehicle are small. The addition of ablated roughness to lifting body configurations causes larger losses in performance and stability than would be expected from the added friction drag due to the roughness. Successful measurements of skin friction have been made in flight to Mach numbers above 4. A reliable inflatable deceleration device was demonstrated in flight which effectively stabilizes and decelerates a lifting aircraft at supersonic speeds.

Pyle, J. S.↗

A study of the oxide dispersion and recrystallization in NiCrAl prepared from preoxidized powder

The SAP technique of dispersion strengthening (formation of an oxide dispersion by preoxidation of metal powders) was applied to atomized powder of the alloy Ni-17Cr-5Al-0.2 Y. SAP-NiCrAl was worked by extrusion and rod rolling at 1205 C and by swaging at 760 C. A variety of annealing treatments were applied after working to determine the recrystallization response. NiCrAlY, similarly prepared from atomized powder, but without a preoxidation treatment, was examined for comparison. The SAP-NiCrAl of this study exhibited oxide particle size and spacing much larger than that usually observed in oxide dispersion strengthened alloys; nonetheless, it was possible to achieve abnormal (secondary) recrystallization in the SAP-NiCrAl as has been reported for other oxide dispersion strengthened alloys. In contrast, unoxidized NiCrAlY exhibited only primary recrystallization.

Glasgow, T. K.↗