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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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At least 37 records · Page 2
All sourcesNASA NTRSDOE OSTI
DOE OSTI2014

Evaluating the Effects of Aluminum-Containing and Non-Aluminum Containing Deodorants on Axillary Skin Toxicity During Radiation Therapy for Breast Cancer: A 3-Armed Randomized Controlled Trial

Purpose: Deodorant use during radiation therapy for breast cancer has been controversial as there are concerns deodorant use may exacerbate axillary skin toxicity. The present study prospectively determined the use of both aluminum-containing and non aluminum containing deodorants on axillary skin toxicity during conventionally fractionated postoperative radiation therapy for breast cancer. Methods and Materials: This 3-arm randomized controlled study was conducted at a single center, tertiary cancer hospital between March 2011 and April 2013. Participants were randomized to 1 of 2 experimental groups (aluminum-containing deodorant and soap or non–aluminum containing deodorant and soap) or a control group (soap). A total of 333 participants were randomized. Generalized estimating equations were used to estimate and compare the odds of experiencing high levels of sweating and skin toxicity in each of the deodorant groups to the odds in the control group. The study evaluated a range of endpoints including objective measurements of axilla sweating, skin toxicity, pain, itch and burning. Quality of life was assessed with a validated questionnaire. Results: Radiation characteristics were similar across all groups. Patients in the deodorant groups did not report significantly different ratings for axillary pain, itch, or burning compared with the control group. Patients in the aluminum-containing deodorant group experienced significantly less sweating than the control; the odds of their sweating being barely tolerable and frequently or always interfering with their daily activities was decreased by 85% (odds ratio, 0.15; 95% confidence interval, 0.03-0.91). Conclusions: We found no evidence that the use of either aluminum-containing or non–aluminum containing deodorant adversely effects axillary skin reaction during conventionally fractionated radiation therapy for breast cancer. Our analysis also suggests patients in the aluminum-containing deodorant arm had significantly less sweating without increased symptoms of axillary radiation skin toxicity. These results add to the evidence that the prescription of deodorants during radiation therapy for breast cancer is now questionable.

62 RADIOLOGY AND NUCLEAR MEDICINE↗
DOE OSTI2020

Comparative Approach for Evaluating the Containment Performance of Legacy NM Storage Containers

Many different types of nuclear material storage containers are used throughout TA-55 and specifically PF-4, in some instances these containers are used outside of engineering control barriers in most cases these barriers are gloveboxes. When a container is used outside of a glovebox or open front hood the container itself is relied upon as the primary engineering control barrier for the user. For this reason a process must be established in order to evaluate Non- Manual Compliant or NMC containers used outside of a glovebox in a comparative approach against Manual compliant containers. Legacy containers are typically understood to be non-standards packaged prior to 1998. For the purposes of this document “legacy” refers to any non-Manual compliant containers.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗
DOE OSTI2024

Water-Resistant Container Testing: 48 oz Bruntmor Container Design

The purpose of this report is to detail the results of water ingress testing conducted on the 48 oz Bruntmor container design and discuss these results against the water-resistant container requirements of TA55-AP 522 and PA-RD-01009. The 48 oz Bruntmor is a proposed commercially off the shelf inner container option for material storage inside of a glovebox and/or as an approved non-hermetically sealed inner of an approved packaging configuration inside of an approved outer container as listed in PA-RD-01022. The 48 oz Bruntmor is shaped like a slip lid container, made of 18-8 stainless steel, and utilizes a smooth, threaded lid with a silicone gasket for closure and containment. This container both lid and body is hot rolled out of 18-8 stainless steel with one seam weld on the body.

42 ENGINEERING↗
DOE OSTI2015

The container database? life-cycle management of container inventories at the Hanford site - 15131

Since 2011 the Department of Energy (DOE) Richland Operations Office (DOE-RL) and their contractor CH2M HILL Plateau Remediation Company (CH2M HILL) have worked together to develop a database that provides life-cycle management and control of all CH2M HILL-managed Department of Transportation (DOT) Type A and Industrial Packaging (IP) container assets at the Hanford Site. This powerful tool provides CH2M HILL with the capability to centrally manage container procurement specifications; maintenance requirements; certificates of conformance; certification and test reports; as-built drawings; and information on container status, location, and ownership; and any special characteristics of container assets. The database was originally developed to provide ready access to Type A and IP container supplier and manufacturer Certificates of Conformance (CoCs) and related certification documentation to support onsite shipments in compliance with the Hanford Site Wide Transportation Safety Document (TSD), DOE/RL-2001-0036, as well as regulatory or other requirements. The information is accessed through active links to these documents within the database itself. The database has grown to include links to external supplementary information to support onsite shipments, such as links to authorized tie downs for each package type, approved packaging and transportation commodities, and approved shipping authorizations, and packaging management procedures and checklists. The database is a living databank that is easily tailored to meet user- and site-specific needs as they are identified. It is currently being expanded to include the inventories of all Hanford contractors, as well as other packaging assets, such as specialty drums and packaging commodities. Each upgrade brings efficiencies and cost savings, not only in container inventory management, but also in the areas of work control, waste packaging, waste transportation, and regulatory compliance. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗
DOE OSTI2014

Arginine-Containing Ligands Enhance H-2 Oxidation Catalyst Performance

In H2 fuel cells, performance depends on factors controlling turnover frequency and energy efficiency in the electrocatalytic oxidation of H2. Nature uses the hydrogenase enzymes to oxidize H2 at high turnover frequencies (up to 20,000 s-1) and low overpotentials (<100 mV), while the fastest synthetic catalyst reported to date only oxidizes H2 at 50 s-1 under 1 atm H2. Here we report a water-soluble complex incorporating the amino acid arginine, [NiII(PCy2NArg2)2]6+, that operates at 210 s-1 (180 mV overpotential) under 1 atm H2 and 144,000 s-1 (460 mV overpotential) under 133 atm H2. The complex functions from pH 0-14 with rates increasing at lower pH values. The arginine groups impart water solubility and play a critical role in enhancing turnover frequency, most consistent with an intramolecular Arg-Arg interaction that controls the structure of the catalyst active site. This work was funded by the Office of Science Early Career Research Program through the US DOE, BES (AD, WJS), and the Center for Molecular Electrocatalysis, an Energy Frontier Research Center funded by the US DOE, BES (JASR). PNNL is operated by Battelle for the US DOE.

amino acid catalyst↗
DOE OSTI2015

Synthesis and Protonation Studies of Molybdenum(0) Bis(dinitrogen) Complexes Supported by Diphosphine Ligands Containing Pendant Amines

A series of molybdenum bis(dinitrogen) complexes of the formula trans-Mo(N2)2(PEtNRPEt)2 (PEtNRPEt = Et2PCH2N(R)CH2Et2; R = phenyl (1), 2,6-difluorobenzyl (2), 3,5-difluorobenzyl (3), CH2CH2NMe2 (4), CH2-o-Py (5)) have been synthesized and characterized by NMR and IR spectroscopy, and X-ray crystallography. Protonation studies with stoichiometric amounts of triflic acid (HOTf) were performed and the the protonated products were characterized by NMR and in situ IR spectroscopic methods. Protonolysis experiments with excess triflic acid were conducted to test for the formation of ammonia from reduction of the dinitrogen ligands. This work was supported as part of the Center for Molecular Electrocatalysis, an Energy Frontier Research Center funded by the U.S. Department of Energy Office of Science, Office of Basic Energy Sciences. S.L. was supported by the DOE Office of Science, Early Career Research Program through the Office of Basic Energy Sciences. Pacific Northwest National Laboratory is operated by Battelle for DOE.

ammonia↗
DOE OSTI2014

Synthesis and Reactivity of Tripodal Complexes Containing Pendant Bases

The synthesis of a new tripodal ligand family is reported, with tertiary-amine groups in the second-coordination sphere. The ligands are tris(amido)amine derivatives, with the pendant amines attached via a peptide coupling strategy. They were designed to be used in new catalysts for the oxygen reduction reaction (ORR), in which the pendant acid/base group could improve catalyst performance. Two members of the new ligand family were each metallated with Co(II) and Zn(II) to afford trigonal monopyramidal complexes. Reaction of the cobalt complexes, [Co(L)]-, with dioxygen reversibly generates a small amount of a Co(III)-superoxo species, which was characterized by EPR. Protonation of the zinc complex Zn[N{CH2CH2NC(O)CH2N(CH2Ph)2}3)-– ([Zn(TNBn)]-) with one equivalent of acid occurs with displacement and dissociation of an amide ligand. Addition of excess acid to the any of the complexes [M(L)]- results in complete proteolysis and formation of the ligands H3L. This decomposition limits the use of these complexes as catalysts for the ORR. An alternative ligand with two pyridyl arms was also prepared but could not be metallated. These studies highlight the importance of stability of the primary-coordination sphere of ORR electrocatalysts to both oxidative and acidic conditions. This research was supported as part of the Center for Molecular Electrocatalysis, an Energy Frontier Research Center funded by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences.

Blacquiere, Johanna M.↗
DOE OSTI2019

Glass structure and crystallization in boro-alumino-silicate glasses containing rare earth and transition metal cations: a US-UK collaborative program

Nuclear wastes generated from reprocessing of used nuclear fuel tend to contain a large fraction of rare earth (RE, e.g., Nd3+), transition (TM, e.g., Mo6+, Zr4+), alkali (A, e.g., Cs+), and alkaline earth cations (AE, e.g., Ba2+, Sr2+). Various strategies have been considered for immobilizing such waste streams, varying from nominally crystal-free glass to glass-ceramic to multi-phase ceramic waste forms. For glass and glass-ceramic waste forms, the added glass-forming system is generally alkali-alkaline earth-aluminoborosilicate (i.e., Na-Ca-Al-B-Si oxide). In a US-UK collaborative project, summarized here, we investigated the glass structure and crystallization dependence on compositional changes in simulated nuclear waste glasses and glass-ceramics. Compositions ranged in complexity from five – to – eight oxides. Specifically, the roles of Mo and rare earths are investigated, since a proposed glass-ceramic waste form contains crystalline phases such as powellite [(AE,A,RE)MoO4] and oxyapatite [(RE,AE,A)10Si6O26], and the precipitation of molybdenum phases is known to be affected by the rare earth concentration in the glass. Additionally, the effects of other chemical additions have been systematically investigated, including Zr, Ru, P, and Ti. A series of studies were also undertaken to ascertain the effect of the RE size on glass structure and on partitioning to crystal phases, investigating similarities and differences in glasses containing single RE oxides of Sc, Y, La, Ce, Nd, Sm, Er, Yb, or Lu. Finally, the effect of charge compensation was investigated by considering not only the commonly assessed peralkaline glass but also metaluminous and peraluminous compositions. Glass structure and crystallization studies were conducted by spectroscopic methods (i.e., Raman, X-ray absorption, nuclear magnetic resonance (NMR), optical absorption, photoluminescence, photoluminescence excitation, X-ray photoelectron spectroscopy), microscopy (i.e., scanning electron microscopy, transmission electron microscopy, electron probe microanalysis), scattering (i.e., X-ray and neutron diffraction, small angle measurements), and physical characterization (i.e., differential thermal analysis, liquidus, viscosity, density). This paper will give an overview of the research program and some example unpublished results on glass-ceramic crystallization kinetics, microstructure, and Raman spectra, as well as some examples of the effects of rare earths on the absorption, luminescence, and NMR spectra of starting glasses. The formal collaboration described here has resulted in the generation of a large number of results, some of which are still in the process of being published as separate studies.

McCloy, John S.↗
DOE OSTI2023

Water-Resistant Container Testing CNUT INGB Container Design (Rev. 1)

The purpose of this report is to detail the results of water ingress testing conducted on the 5Qt Castle Nut In-Glovebox (5QtCNUT INGB) container design and discuss these results against the water-resistant container requirements of TA55-AP- 522 and PA-RD-01009. The CNUT is a general-purpose container option for material storage inside of a glovebox and/or as an approved non-hermetically sealed inner of an approved packaging configuration inside of an approved outer container as listed in PA-RD-01022. The CNUT containment boundary consists of a filtered lid and deep drawn body with welded collar all made of 316L stainless steel, an aluminum bronze spin down ring to provide compression of a to Viton® O-ring to create a seal for closure and containment.

36 MATERIALS SCIENCE↗
DOE OSTI2019

FY19 Status of the Full Circumference Examination of the Inner Container Closure Weld Region for Selected 3013 DE Containers

One of the main focus areas of the 3013 Surveillance Program is a thorough evaluation of the inner container closure weld region (ICCWR) opened for destructive examination (DE). As part of the protocol to investigate the corrosion in the ICCWR a laser confocal microscope (LCM) is used to perform close visual examination of the surface and measurements of corrosion features on the surface. In FY17, DE containers from FY13 through FY16 were evaluated to select candidates for a full circumference analysis of the ICCWR. In FY18, the selected DE containers for full circumference evaluation (FCE) were processed according to the ICCWR protocol and LCM data collection was completed for the full circumference only for FY15 DE07. In FY19 the remaining DE containers were completed. The ICCWR protocol was completed as follows: (1) the FCE containers were sectioned into quarters and the weld removed to access the ICCWR; (2) a series of images of the ICCWR full circumference were taken using a stereo microscope and assembled into panoramic views; (3) SEM/EDS analysis performed on selected sections showed what is most likely corrosion products on the surface and chlorides randomly dispersed; (4) the presence of chlorides was also confirmed with ion chromatography of citric acid washes, in which FY15 DE07 and FY16 DE05 showed a significant amount of chlorides with FY15 DE08 showing the less amount of chlorides; (5) dye penetrant examination was performed on the interior and exterior surfaces of all the sidewall sections but reveled no relevant indication of surface-breaking defects, (6) finally, as described above, the full circumference examination of the ICCWR by LCM was completed. The three ICCWRs show general and localized corrosion on the surface. However, FY15 DE08 show more areas with agglomerated pits in Zones 2 and 3 than the other two DEs. The major suspect corrosion events were observed for FY15 DE07 on Sections C1 and C2 and for FY15 DE08 on Section C2. These events correspond to suspect cracks or crack-like features identified with a unique name to easily refer to each feature. FY15 DE07 shows a crack-like feature, identified as Acrux, in Section C1 and three features in Section C2 identified as Bellatrix, Cursa Minor and Cursa Major. Acrux and Bellatrix are located at the boundary of Zone 2 and Zone 3. Cursa Minor and Cursa Major are in Zone 2. FY15 DE08 shows two crack-like features, identified as Denebola and Draco, in Section C2. Both features are located at the boundary of Zone 2 and Zone 3. However, gas analysis and statistical evaluation of the gas compositions and pressures via GEST analyses suggest that leakage between the OI and IC volumes was unlikely. Additional characterization and analysis will be performed on the locations where the cracks were found.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗
DOE OSTI2019

LANL Phase 3 Test Plan For Container Loading to Support the Fire-Induced Pressure Response and Failure Characterization of PCV/SCV/3013 Containers

Fire testing of 3013 containers loaded with surrogate materials and water will be conducted to determine the response of 3013 containers stored in K-Area Complex (KAC) to a facility fire. Based on the proposal for the test configuration and loading, the objectives of the fire test are as follows: 1. “To increase understanding about the pressure and temperature conditions at which failure occurs; 2. To determine the allowable moisture for which failure will not occur under specified fire conditions, and 3. To increase understanding regarding the effects of salts on the pressurization, corrosion, and potential failure of the container.” Surrogate materials will be prepared at Los Alamos National Laboratory (LANL) and loaded in the 3013 containers. The containers will then be welded at LANL and shipped to Savannah River Site (SRS) for the installation of fittings and leak testing.

42 ENGINEERING↗
DOE OSTI2023

Water-Resistant Container Testing: A846-500 Container Design

The purpose of this report is to detail the results of water ingress testing conducted on the A846-500 container design and discuss these results against the water-resistant container requirements of TA55-AP-522 and PA-RD-01009. The A846-500 is a proposed commercially off the shelf inner container option for material storage inside of a glovebox and/or as an approved non-hermetically sealed inner of an approved packaging configuration inside of an approved outer container as listed in PA-RD-01022. The A845-500 is shaped similar to a soda bottle (wide cylindrical base with a narrow, tapered neck at the top), made of 316L stainless steel, and utilizes a knurled, threaded lid with a silicone gasket for closure and containment.

42 ENGINEERING↗
DOE OSTI2024

The Uranium-Containing and Thorium-Containing Anions Studied by Photoelectron Spectroscopy

An in-depth knowledge of actinide chemistry is fundamental to many aspects of nuclear science and technology, including the synthesis and processing of materials and the remediation of waste disposal sites. Among the actinides, the chemical bonding behaviors of actinium and thorium resemble those of the transition metals; the 5f-electrons of protactinium, uranium, neptunium, and plutonium often play important roles in their bonding; and among the still heavier elements, their bonding tends to mimic the lanthanide elements in terms of electron shielding and their f-electron contributions. Bonding that involves 5f-electrons, however, is especially important, in part because of the significance of uranium and plutonium, but also because these elements are among the few where f-electron participation in bonding is relatively common. This work focused on studying uranium-containing and thorium-containing anions in the gas phase using negative ion photoelectron spectroscopy. Since this technique directly probed valence electrons, it was uniquely positioned to address open questions regarding molecular bonding and electron configurations. A particularly important issue concerned how bonding in actinide-containing molecules was affected by modifications to their actinide atoms’ environment, i.e., due to their interaction with ligands. A closely related question was how actinide atoms’ suborbitals were qualitatively reordered and their energies quantitatively shifted as a result of their ligated environments. These were especially relevant issues in regard to uranium due to it having multiple possible oxidation states (OS) and the potential for 5f electron participation in bonding. The effects of ligands on oxidation states and 5f-orbital energies in uranium bonding was expected to be pronounced. Both ligands and excess electrons were seen as probes of actinide atoms within actinide-containing molecules. Our strategy for advancing knowledge of chemical bonding in the actinide-containing species utilized the synergy between experiments and theory, where in some cases experimental results validated theory and where in others computational results assisted in interpreting experiments. Calculations on actinide systems are terrifically challenging due to large spin-orbit interactions, relativistic effects, and just the sheer number of electrons involved. Even in the simplest species, e.g., U and U2, the most sophisticated, modern calculations carried out by the most experienced theorists often only approximate experimentally-measured values, such as electron affinities. For theory to provide confident predictions that can be used to solve real problems it needed an iterative and ultimately corrective mechanism by which its methods can develop further. Experiments can be used to identify when theory has failed; whereupon the subsequent process of using the experiment-theory interplay can be used to find the cause of the failure. Upon fixing it in one case, different test species can be proposed and studied by the experiment-theory combination to determine whether the problem has been corrected. Thus, experiments not only measure the values of molecular properties, they also provide navigational 3 beacons that keep computations off the reefs in an otherwise dark sea with few reference points. Experimental measurements in the actinide field are not only important, they are in actuality essential to computational progress. While it was not always possible to compare the theoreticallydetermined quantity of interest directly with the same experimentally-measured observable, it was usually possible to compare consequential properties that are both calculable and measurable. In the work completed here electron affinities and electronic state spacings were often sensitive consequential parameters. Reasonable agreement between measured and computational values signaled that a calculation that was very likely to be on-track. We had established collaborative relationships with five computational groups, all of which have expertise in computational actinide chemistry. Their PI’s are L. Cheng, D. Dixon, L. Gagliardi, K. Peterson, and B. Vlaisavljevich. Our close interaction with our theory partners led to us suggesting systems to them and them to us. This reciprocal interaction between our experimental and their computational results was among the most important strengths of this work and was a thread woven throughout. Even though anion photoelectron spectroscopic studies are conducted on anions, much of the information that they provide, pertains to the electronic structure of the neutral counterparts of those anions; among these are electron affinities and electronically excited state spacings. Our experimental tools included several specialized ion sources for forming the anionic species of interest, a mass spectrometer for identifying and mass-selecting them, and an anion photoelectron spectrometer for determining their electron affinities (EA) and characterizing the electronic states of the selected anions’ neutral counterparts. Anion photoelectron spectroscopy is conducted by crossing a mass-selected beam of anions with a fixed-frequency laser beam and energy-analyzing the resultant photodetached electrons. The photodetachment process is governed by the energyconserving relationship: hν = EBE + EKE, where hν is the photon’s energy, EBE is the electron binding (photodetachment transition) energy, and EKE is the electron’s kinetic energy. In our apparatus mass-selection is accomplished via time-of-flight mass spectrometry (TOF-MS), electron energy analysis is achieved with either a magnetic bottle or by velocity mapped imaging. Photodetachment of electrons from anions is implemented via either Nd:YAG or excimer lasers. The photodetachment transition energy, i.e., the EBE, between the ground vibrational and electronic state of an anion and the ground vibrational and electronic state of that anion’s neutral counterpart is the adiabatic electron affinity (EA) of that neutral molecule. Likewise, photodetachment transitions between the ground vibrational and electronic state of an anion and the various electronically-excited states of that anion’s corresponding neutral map the electronic spectrum of that neutral species, i.e., the spectral spacings in the photoelectron spectrum are a mirror image of the neutral’s electronic spectrum. It was, of course, crucial to be able to form the anionic species of interest. There, we had a particularly broad field of anion sources from which to choose. These included several variants of pulsed laser vaporization (LV), laser photoemission, infrared desorption plus photoemission, pulsed arc discharge (PACIS), electrospray ionization (ESI), and Rydberg electron transfer (RET). Each of these anion sources were readily combined with, i.e., connected to, the anion photoelectron spectroscopic portion of our apparatus as described above. Among the sources that utilize lasers, visible light for LV sources as well as IR for desorption sources are provided by Nd:YAG lasers. Ultraviolet photons are provided by both Nd:YAG and excimer lasers, whereas the excitation wavelengths for RET experiments come from two Nd:YAG-pumped dye lasers.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗