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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 559 records · Page 31
All sourcesNASA NTRSDOE OSTI
DOE OSTI2013

On the superconducting symmetry of Fe-based systems — Impurity effect studies and neutron scattering measurements-

To identify the superconducting symmetry of Fe-based superconductors, we studied effects of nonmagnetic-impurities on T c , magnetic excitation spectra x" and NMR 1/T 1 - T curve, which are sensitive to the relative signs between the order parameters on the disconnected Fermi surfaces in reciprocal space, because the symmetry is closely connected with the pairing mechanism: If the signs are opposite (symmetry S ± ), the mechanism is considered to be a magnetic one, but when the signs are the same (symmetry S ++ ), a novel mechanism is plausible because the ordinary phonon mechanism cannot realize the T c value as high as ~55 K found in Ln1111 (Ln=lanthanide). Results are as follows: (a) The very small rates of T c -suppression by impurity atoms M of LnFe 1-y M y As 0.89-x F 0.11+x (M=Ni, Co, Ru) can be explained only by S ++ . (b) The x"-data for Ba(Fe, Co) 2 As 2 (T c ~ 23 K) and Ca-Fe-Pt-As crystals seem to be well explained by S ++ rather than by S ± . (c) The nuclear magnetic resonance data can be consistently understood by S ++ , too. These results suggest the S ++ symmetry and a novel pairing mechanism, which can be considered to be related to the elastic softening of C 66 induced by the orbital fluctuation of the system.

47 OTHER INSTRUMENTATION↗
DOE OSTI2017

Bismuth interstitial impurities and the optical properties of GaP 1- x - y Bi x N y

Two distinctive regimes of behavior are observed from GaP 1-x-y Bi x N y alloys with x < 2.4%, y < 3.4% grown by molecular beam epitaxy. These regimes are correlated with abundant bismuth interstitial impurities that are encouraged or suppressed according to the sample growth temperature, with up to 55% of incorporated bismuth located interstitially. When bismuth interstitials are present, radiative recombination arises at near-band-edge localized states rather than from impurity bands and deep state luminescence. Finally, this change demonstrates a novel strategy for controlling luminescence in isoelectronic semiconductor alloys and is attributed to a disruption of carrier transfer processes.

36 MATERIALS SCIENCE↗
NASA NTRS2022

Polarization as a Discriminator of Light-Absorbing Impurities in or Above Snow

This conceptual study presents advanced radiative transfer computations of light polarization originating from a snowpack consisting of nonspherical grains and variable content of light-absorbing impurities, either embedded in the snowpack or (with the same optical properties) lofted above it in the form of atmospheric aerosols. The results highlight the importance of considering shapes other than spherical for the snow grains, which otherwise can lead to non-negligible errors in the retrieval of snow albedo from remote sensing observations. More importantly, it is found that polarimetric measurements provide a means to partition light-absorbing impurities embedded in the snowpack from absorbing aerosols aloft, a task traditionally prohibitive for sensors capable exclusively of measurements of total reflectance. Heritage techniques to obtain snow grain size from shortwave infrared observations of total reflectance are well established, as are those that leverage polarimetric, multiangular observations across the entire optical spectrum to characterize the optical and microphysical properties of atmospheric aerosols. The polarization signatures of near-infrared (e.g., 864 nm) observations carry critical information on snow grain shape. The prospected launch of space-borne polarimeters with proven accuracy, therefore, advocates for the development of data inversion schemes, to boost the accuracy of simultaneous retrievals of atmospheric and surface parameters in the polar and snow-covered regions, critical to climate studies.

light polarization↗
DOE OSTI2021

1,3,5-Trichloro-2,4,6-Trinitrobenzene: The Elusive Impurity Standard

1,3,5-triamino-2,4,6-trinitrobenzene (TATB) is an insensitive high explosive synthesized in two steps; 1,3,5-trichloro-2,4,6-trinitrobenzene (TCTNB) is the only intermediate. Due to solubility limitations, TATB is often dissolved in dimethylsulfoxide (DMSO) for liquid chromatography-mass spectrometry (LC–MS) analyses; however, DMSO is capable of participating in a wide variety of reactions. Intending to use it as an impurity standard, TCTNB was dissolved in DMSO. A stark color change from colorless to yellow accompanied by wavelength and ion chromatogram changes occurred over 24 hours. Three compounds were identified as causing the color change. All three were present in both acetone and DMSO solutions, but, overtime the absorbance spectra of the DMSO solution changed indicating an underlying reaction occurs between these compounds and DMSO. The chemical formulas of impurities present in the TCTNB sample as well as reaction products are identified via quadrupole time of flight mass spectrometry. The chemical structures are also proposed. The combination of the solvent system, ionization technique, and halogenated/nitrated aromatic ring structures resulted in substitutions of both the chlorine and nitro groups to hydroxyl groups. Furthermore, three proposed structures were closely related to TCTNB, but only one was detected at a consistent mass and absorbance wavelength in both acetone and DMSO. This compound had undergone a chlorine to hydroxyl substitution and should be utilized for TCTNB detection.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2019

Deep-Level Defects and Impurities in InGaN Alloys

In this study, density functional theory calculations with a hybrid functional are used to examine the charge-state transition levels of native point defects and impurities in InGaN alloys, with the goal of identifying centers that play a role in defect-assisted recombination. Explicit alloy calculations are used to monitor the dependence of defect levels on indium content and distribution of In atoms. The relative shift (or lack thereof) of the charge-state transition levels of the different defects is explained by the atomic character of the defect state and whether it is derived from valence-band or conduction-band states of the host material or acts as an atomic-like impurity. The various possible atomic configurations of In and Ga cations for a given composition of InGaN lead to a distribution of charge-state transition levels. Defects on the nitrogen site lead to a larger spread in levels compared with defects on the cation site.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2025

Impurity Powder Injection Experiments in the Large Helical Device

The Impurity Powder Dropper (IPD) is a device capable of injecting controlled amounts of sub-millimetre powder into the plasma under the action of gravity. In 2019 the IPD was first installed on the Large Helical Device (LHD) in Japan, with the aim of improving the plasma performances through real time boronization and assessing the compatibility of this technique with steady state operation. Extensive series of experiments have been performed using the IPD, focused on the improvement of the plasma performance via low-Z powder injection and the understanding of the underlying physical phenomena. In this article, we review the experiments that took place in the period 2019-2024. The main results include the demonstration of the improvement of the wall conditions (reduction of intrinsic impurity content, wall recycling) both on a shot-to-shot basis and in real time. Furthermore, a reduced-turbulence improved confinement regime has been observed coincident with powder injection, resulting in an increase of the plasma temperature of the order of 25%, with enhancements that can reach up to 50% for ion temperature.

Nespoli, F. [Princeton Plasma Physics Laboratory (↗
DOE OSTI2015

When small is big: the role of impurities in electrocatalysis.

Improvements in the fundamental understanding of electrocatalysis have started to revolutionize the development of electrochemical interfaces for the efficient conversion of chemical energy into electricity, as well as for the utilization of electrons to produce new chemicals that then can be re-used in energy conversion systems. Here, some facets of the role of trace level of impurities (from 10-7 to 10-6 M) in electrocatalysis of the oxygen reduction reaction, hydrogen oxidation and evolution reactions, and CO oxidation reactions are explored on well-characterized platinum single crystal surfaces and high surface area materials in alkaline and acidic environments. Of particular interest is the effect of anions (e.g., Cl-, NO3-) and cations (i.e., Cu2+) present in the supporting electrolytes as well as surface defects (i.e., ad-islands) that are present on metal surfaces. The examples presented are chosen to demonstrate that a small level of impurities may play a crucial role in governing the reactivity of electrochemical interfaces.

Strmcnik, Dusan↗
DOE OSTI2014

An impurity-induced gap system as a quantum data bus for quantum state transfer

We introduce a tight-binding chain with a single impurity to act as a quantum data bus for perfect quantum state transfer. Our proposal is based on the weak coupling limit of the two outermost quantum dots to the data bus, which is a gapped system induced by the impurity. By connecting two quantum dots to two sites of the data bus, the system can accomplish a high-fidelity and long-distance quantum state transfer. Numerical simulations for finite system show that the numerical and analytical results of the effective coupling strength agree well with each other. Moreover, we study the robustness of this quantum communication protocol in the presence of disorder in the couplings between the nearest-neighbor quantum dots. We find that the gap of the system plays an important role in robust quantum state transfer.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2021

Measurement of 227 Ac impurity in 225 Ac using decay energy spectroscopy

225 Ac is a valuable medical radionuclide for targeted $\alpha$ therapy, but 227 Ac is an undesirable byproduct of an accelerator-based synthesis method under investigation. Sufficient detector sensitivity is critical for quantifying the trace impurity of 227 Ac, with the 227 Ac/ 225 Ac activity ratio predicted to be approximately 0.15% by end-of-bombardment (EOB). Superconducting transition edge sensor (TES) microcalorimeters offer high resolution energy spectroscopy using the normal-to-superconducting phase transition to measure small changes in temperature. By embedding 225 Ac production samples in a gold foil thermally coupled to a TES microcalorimeter we can measure the decay energies of the radionuclides embedded with high resolution and 100% detection efficiency. This technique, known as decay energy spectroscopy (DES), collapses several peaks from $\alpha$ decays into single Q-value peaks. In practice there are more complex factors in the interpretation of data using DES, which we will discuss in this paper. Using this technique we measured the EOB 227 Ac impurity to be (0.142 ± 0.005)% for a single production sample. This demonstration has shown that DES is a useful tool for quantitative measurements of complicated spectra.

07 ISOTOPE AND RADIATION SOURCES↗
DOE OSTI2023

Effect of pressure on high-temperature oxidation of Ni alloys in supercritical CO 2 containing impurities

Direct supercritical CO 2 (sCO 2 ) power cycles require structural materials compatible with hot sCO 2 containing high levels of water and oxygen impurities. Chromia-forming Ni-based superalloys, which are leading candidates at temperatures > 600 °C, have shown good compatibility in pure sCO 2 , however potential impurity effects are not well understood. In this report we exposed several commercial Ni-based alloys to 95%CO 2 -4%H 2 O-(1-3)%O 2 at 750 °C and 0.1 or 20 MPa for 2500 h. Protective chromia scales formed in all cases. Nevertheless, water vapor-assisted oxide volatilization clearly occurred at high pressure. The volatilization rates decreased with time, but still represent a potentially serious compatibility issue in real, high-velocity, sCO 2 systems.

36 MATERIALS SCIENCE↗
DOE OSTI2022

A comparison of carbon impurities in pre- and post-melt uranium Part 1: Scanning electron microscopy analysis

Although C impurities in U have been studied for decades, fundamental questions regarding their incorporation, migration, and overall transformation during metal processing still exist. In two written Parts, we compare the chemical speciation, distribution, crystallography, and morphologies (size, shape, etc.) of carbon-containing impurities in U metal both before and after melting using high resolution analytical electron microscopy (AEM). This first Part demonstrates the variability of carbide inclusions in depleted U (DU) metal with respect to their chemical phases and morphologies as observed by scanning electron microscopy (SEM). Here, a variety of inclusion types, such as the pill-shaped U monocarbide (UC), previously only hypothesized, are summarized. Additionally, delineation between hopper-shaped U carbonitride U(C,N) and dendritic UC inclusions is discussed in relationship to archived literature.

36 MATERIALS SCIENCE↗
DOE OSTI2016

Sensitivity of measured steam oxidation kinetics to atmospheric control and impurities

The most direct means of improving the ability of water cooled reactors to withstand excessive cladding oxidation during a loss of coolant accident is to either modify or replace zirconium cladding. It is important to understand what level of agreement is to be expected as a function of systematic differences in steam oxidation testing techniques and instrumentation among testing facilities. This study was designed to assess the sensitivities of some of the current and proposed reactor cladding materials. Steam oxidation sensitivity of Zircaloy-2, FeCrAl and Mo to O 2 impurities in steam were examined. It was shown that the effect of O 2 impurities is negligible for the two former materials while significant in the case of Mo.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗
DOE OSTI2019

High-temperature Tribological Behavior of Structural Materials after Conditioning in Impure-Helium Environments for High_temperature Gas-Cooled Reactor Applications

Incoloy 800HT and Inconel 617 have been selected as candidate structural alloys for the hightemperature gas-cooled reactor (HTGR) concept. Helium, the primary coolant, contains impurities (e.g., H2O and CH4) that can induce corrosion reactions at high temperatures, which in turn can affect the tribological behavior of components in sliding contact such as valves and control-rod drive systems. This paper presents results from the study of the tribological behavior of both alloys before and after conditioning them in either an impure-helium oxidizing environment or in an air environment. Both alloys were conditioned for 22 days at elevated temperatures in a once-through helium loop with 4 ppmv H2O and tested subsequently at elevated temperatures with a pin-on-disk tribometer in an air environment 650 degrees C and 750 degrees C for 800HT; 850 degrees C and 900 degrees C for 617 - with various applied loads - 1 N, 2 N and 5 N. SEM-EDS analysis revealed that conditioning the samples in an oxidizing environment leads to the formation of a mixed Fe/Cr-oxide on alloy 800HT and a Cr-oxide on alloy 617, both increasing the wear resistance compared to that of as-received samples. Alloy 617 exhibited lower steady-state friction coefficients compared to those of alloy 800HT. There was a significant decrease in the scatter of the steadystate friction coefficient of the conditioned samples compared to that of the unconditioned samples. The steady-state friction coefficient for alloy 800HT and 617 were found to be 0.53 +/- 0.07 and 0.25 +/- 0.04, respectively. The wear resistance of alloy 800HT is approximately one order of magnitude lower than that of alloy 617 in all cases that exhibited measurable wear. After sample conditioning, the wear volumes measured at low loads were undistinguishable from the unworn background, a result attributed to the formation of a compacted glaze layer under high temperatures and high contact stresses.

Alloys 800 and 617↗
DOE OSTI2017

Expanding the role of impurity spectroscopy for investigating the physics of high-Z dissipative divertors

New techniques that attempt to more fully exploit spectroscopic diagnostics in the divertor and pedestal region during highly dissipative scenarios are demonstrated here using experimental results from recent low-Z seeding experiments on Alcator C-Mod, JET and ASDEX Upgrade. To exhaust power at high parallel heat flux, $q_∥$ > 1 GW/m 2 , while minimizing erosion, reactors with solid, high-Z plasma facing components (PFCs) are expected to use extrinsic impurity seeding. Due to transport and atomic physics processes which impact impurity ionization balance, so-called ‘non-coronal’ effects, we do not accurately know and have yet to demonstrate the maximum $q_∥$ which can be mitigated in a tokamak. Radiation enhancement for nitrogen is shown to arise primarily from changes in Li- and Be-like charge states on open field lines, but also through transport-driven enhancement of H- and He-like charge states in the pedestal region. Measurements are presented from nitrogen seeded H-mode and L-mode plasmas where emission from N 1+ through N 6+ are observed. Active charge exchange spectroscopy of partially ionized low-Z impuri- ties in the plasma edge is explored to measure N 5+ and N 6+ within the confined plasma, while passive UV and visible spectroscopy is used to measure N 1+ -N 4+ in the boundary. Examples from recent JET and Alcator C-Mod experiments which employ nitrogen seeding highlight how improving spectroscopic coverage can be used to gain empirical insight and provide more data to validate boundary simulations.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2021

Effects of Casting Parameters and Impurity Concentrations on As-Cast U–10Mo

This work investigates the effects of casting parameter changes on as-cast uranium-10 wt% molybdenum alloys on a 1-2kg scale. A commercial tilt-pour vacuum induction melting system was utilized to study the effects of casting atmosphere, total heating time, hold time at maximum temperature, mold temperature, and crucible type on the as-cast microstructure of U-10Mo. Ten thin plates (5.08 mm thick) and four thick plates (25.4 mm and 63.5 mm thick) were cast and analyzed for carbon, oxygen, hydrogen, and nitrogen impurities. Additionally, molybdenum content and primary dendrite length (PDL) of the microstructure was quantified. A statistical evaluation was performed to identify key carbon and oxygen relationships with operating parameters, impurities, and primary dendrite length. Additional factors investigated include: crucible material, time at maximum temperature, total heating time, and pour temperature. Zirconia crucibles reduced carbon content on average by 35%. Additionally, there was a significant statistical association between carbon and oxygen content, between oxygen content and maximum temperature hold time, between mold temperature and PDL, and between PDL, maximum temperature hold time and mold temperature.

Huber, Zachary F.↗
DOE OSTI2021

Opposing Effects of Impurity Ion Sr 2+ on the Heterogeneous Nucleation and Growth of Barite (BaSO 4 )

Nucleation of barite (BaSO 4 ) has broad implications in geological, environmental, and materials sciences. While impurity metals are common, our understanding of how they impact nucleation remains dim. In this work, we used classical optical microscopy compared to fast X-ray nanotomography (XnT) to investigate heterogeneous nucleation of barite on silica in situ with Sr 2+ as an impurity ion. The observed barite nucleation rates were consistent with classical nucleation theory (CNT), where barite crystals displayed a nonuniform size distribution, exhibiting distinct morphologies and incubation periods in Sr-free solutions. While undetectable with optical microscopy, nanotomography revealed that addition of Sr2+ enhances nucleation rates driven by the pre-factor in CNT, likely because both adsorbed Ba 2+ and Sr 2+ act as precursor sites on which nucleation occurs. Sr 2+ simultaneously inhibits growth, however, leading to a homogeneous distribution of smaller crystals. This finding will enable an improved predictive understanding of nucleation in natural and synthetic environments.

36 MATERIALS SCIENCE↗