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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 343 records · Page 19
All sourcesNASA NTRSDOE OSTI
DOE OSTI2019

Anisotropic Superconducting Gap in Optimally Doped Iron–Based Material

In this work we offer a comprehensive optical investigation of the optimally hole-doped Ba 0.6 K 0.4 Fe 2 As 2 over a broad spectral range, as a function of temperature and of tunable applied stress, which acts as an external symmetry breaking field. We show that there is a large electronic nematicity at optimal doping which extends right under the superconducting dome and implies an anisotropy of the superconducting energy gaps.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2018

A New Approach to Processing Rutile from Ilmenite Ore Utilizing the Instability of Pseudobrookite

Rutile (TiO{sub 2}) is a vital industrial material used in pigments and in many other valuable chemicals. A new production process to synthesize rutile from natural ilmenite ore and therefore overcome the environmental problems associated with conventional rutile extraction processes was developed. Because the simple phase separation of ilmenite (FeTiO{sub 3}) into Fe{sub 2}O{sub 3} and TiO{sub 2} occurs due to air oxidation, extracting TiO{sub 2} by removing Fe{sub 2}O{sub 3} may be possible if pseudobrookite (Fe{sub 2}TiO{sub 5}), known as a stable compound in the Fe{sub 2}O{sub 3}-TiO{sub 2} system at higher temperatures, is of unstable phase in the lower-temperature range. In order to clarify the potential of this new approach, the phase stability of pseudobrookite in the lower-temperature range is discussed. The free energy of formation of pseudobrookite from the respective pure oxides was measured at temperatures ranging from 1073 K to 1473 K by the chemical equilibrium technique using Al{sub 2}O{sub 3} as the reference oxide. The observed free energy is given as a function of temperature: ∆G{sup 0} = 7715 − 7.7T (J/mol). The results indicate that pseudobrookite has an unstable phase below 929 K. This has important industrial implications as a new approach to producing synthetic rutile from ilmenite ore by oxidation at low temperatures and acid leaching.

36 MATERIALS SCIENCE↗
DOE OSTI2017

Influence of Asymmetric Cyclic Loading on Structural Evolution and Deformation Behavior of Cu-5 at.% Zr Alloy: An Atomistic Simulation-Based Study

Molecular dynamics (MD) simulation-based studies of tensile test and structural evolution of Cu-5 at.% Zr alloy under asymmetric cyclic loading (i.e., ratcheting behavior) considering various stress ratios such as − 0.2, − 0.4 and − 0.6 for different temperatures, viz.≈ 100, 300 and 500 K have been performed using embedded atom model Finnis–Sinclair potential. According to obtained stress–strain response from MD calculation, Cu-5 at.% Zr alloy specimen is pristine in nature as sudden drop in stress just after yield stress and subsequent elastic type deformation are observed for this alloy. Predicted ratcheting strain by MD simulation for Cu-5 at.% Zr alloy varies from 4.5 to 5%. Significant increase in ratcheting strain has been observed with the increase in temperature. Slight reduction in crystallinity is identified at the middle of the each loading cycle from the performed radial distribution function analysis and cluster analysis.

36 MATERIALS SCIENCE↗
DOE OSTI2018

Solar Light Responsive Photocatalytic Activity of Reduced Graphene Oxide–Zinc Selenide Nanocomposite

Solution processable reduced graphene oxide–zinc selenide (RGO–ZnSe) nanocomposite has been successfully synthesized by an easy one-pot single-step solvothermal reaction. The RGO–ZnSe composite was characterized structurally and morphologically by the study of XRD analysis, SEM and TEM imaging. Reduction in graphene oxide was confirmed by FTIR spectroscopy analysis. Photocatalytic efficiency of RGO–ZnSe composite was investigated toward the degradation of Rhodamine B under solar light irradiation. Our study indicates that the RGO–ZnSe composite is catalytically more active compared to the controlled-ZnSe under the solar light illumination. Here, RGO plays an important role for photoinduced charge separation and subsequently hinders the electron–hole recombination probability that consequently enhances photocatalytic degradation efficiency. We expect that this type of RGO-based optoelectronics materials opens up a new avenue in the field of photocatalytic degradation of different organic water pollutants.

77 NANOSCIENCE AND NANOTECHNOLOGY↗
DOE OSTI2018

Reduced Graphene Oxide–Cadmium Zinc Sulfide Nanocomposite with Controlled Band Gap for Large-Area Thin-Film Optoelectronic Device Application

Herein, we report the one pot single step solvothermal synthesis of reduced grapheme oxide–cadmium zinc sulfide (RGO–Cd{sub 0.5}Zn{sub 0.5}S) composite. The reduction in graphene oxide (GO), synthesis of Cd{sub 0.5}Zn{sub 0.5}S (mentioned as CdZnS in the text) nanorod and decoration of CdZnS nanorods onto RGO sheet were done simultaneously. The structural, morphological and optical properties were studied thoroughly by different techniques, such as XRD, TEM, UV–Vis and PL. The PL intensity of CdZnS nanorods quenches significantly after the attachment of RGO, which confirms photoinduced charge transformation from CdZnS nanorods to RGO sheet through the interface of RGO–CdZnS. An excellent photocurrent generation in RGO–CdZnS thin-film device has been observed under simulated solar light irradiation. The photocurrent as well as photosensitivity increases linearly with the solar light intensity for all the composites. Our study establishes that the synergistic effect of RGO and CdZnS in the composite is capable of getting promising applications in the field of optoelectronic devising.

77 NANOSCIENCE AND NANOTECHNOLOGY↗
DOE OSTI2018

Synthesis of Flexible Graphene/Polymer Composites for Supercapacitor Applications

In this paper, the graphene was synthesized using biocompatible cellulosic component from onions. Onion epidermal cells were chosen as raw material. During heating at high temperature, the bonding among atoms in material was rearranged and forms two-dimensional hexagonal carbon layer (graphene). The characterization of synthesized graphene was done by x-ray diffractometer, Raman spectrometer and field emission scanning electron microscopy, respectively. An attempt has been taken to form the capacitors with two different current collector electrodes, anticipating the performance of the supercapacitors. The observed capacitance values as-obtained for Al and Au current collector were 1.3 μF and 6.08 μF, respectively. However, when thermally exfoliated graphene was used as an electrode on Al and Au current collector, the capacitance value was drastically increased and found to be 1.6 and 41.25 μF, respectively.

77 NANOSCIENCE AND NANOTECHNOLOGY↗
DOE OSTI2019

Microstructure and Work Hardening Behavior of Micro-plasma Arc Welded AISI 316L Sheet Joint

The aim of this research is to investigate the microstructural changes and work hardening behavior of AISI 316L 0.5-mm-thick sheet due to micro-plasma arc welding. AISI 316L similar sheets were welded in single-pass square butt joint configuration. The microstructure in the fusion zone typically contains a variety of complex δ-ferrite-austenitic structure, which significantly increased hardness value compared to the base material because of rapid solidification of the weld pool. Systematic tensile test was performed to investigate strain rate sensitivity of the welded joint under quasi-static loading conditions. The multistage work hardening behavior was determined by Kocks–Mecking (K–M) model and differential Crussard–Jaoul analysis. In both the cases, stage III work hardening behavior and stage IV work hardening behavior were observed. The stress–strain curves of welded specimen at different strain rates were analyzed in terms of Hollomon, Ludwik and Swift equations to determine work hardening exponent values. The welded joints were ruptured in the transition zone of heat affected and fusion zones. The fractographic observation exhibited variation in dimple and void density over strain rate from 0.0001 to 0.0015 s{sup −1}.

36 MATERIALS SCIENCE↗
DOE OSTI2019

Molecular Dynamics Simulation Study of Uniaxial Ratcheting Behaviors for Ultrafine-Grained Nanocrystalline Nickel

In this paper, molecular dynamics (MD) simulation-based study of deformation behavior of ultrafine-grained nanocrystalline nickel under asymmetric cyclic loading having stress ratios (R) such as − 0.2, − 0.4 and − 0.6 for different temperatures, viz. 100, 300 and 500 K, has been performed using embedded atom method potential. The predicted ratcheting strain by MD simulation for nanocrystalline Ni varies from 15 to 30%. A significant increase in ratcheting strain has been observed with the increase in temperature. It has been observed that the number of vacancies increases, and the number of clusters decreases with the increase in temperature. Slight reduction in crystallinity is identified at the middle of the each loading cycle from the performed cluster analysis. Zigzag pattern of dislocation density has been observed and leads to the decrease in dislocation density with the increase in temperature. Stress ratio does not show any significant effect on the number of vacancies, clusters and dislocation density on structural evolution during the asymmetric cyclic loading. Slight change in the grain rotation has been observed with the increase in temperature, and there is almost no change in the final texture evolved. From the post-tensile tests, ultimate tensile strength that remains same may be due to constant average dislocation density.

36 MATERIALS SCIENCE↗
DOE OSTI2019

Effect of Tool Offset and Rotational Speed in Dissimilar Friction Stir Welding of AISI 304 Stainless Steel and Mild Steel

In the present study, dissimilar friction stir welding was carried out between stainless steel (UNS S30400) and mild steel (UNS G10080) plates of 4 mm thickness using a tungsten carbide tool. The influence of tool rotational speeds (600, 875 rpm) and tool offsets (0.6, 1.2 mm) on mechanical properties, i.e., hardness, tensile strength, and impact toughness of welded joints was investigated. Maximum tensile strength of the joint was about 107.6% of the mild steel under rotational speed of 875 rpm and tool offset of 1.2 mm. The maximum hardness reached in the stir zone was about 281 HV{sub 0.5} due to the phase transformations and grain refinement. Charpy’s notch toughness of the welded joints was observed lower than the base materials. The microstructural characterizations were carried by using an optical microscope, and FESEM–EDS analysis which revealed the complex material mixing and material movement during the welding. Tungsten-rich bands were observed in the weld micrograph especially toward the advancing side. During this study, various wear mechanisms like oxidation wear, abrasive wear, and adhesion wear were responsible for the degradation of tungsten carbide tool.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Finite Element Analysis and Techno-economic Modeling of Solar Silicon Molten Salt Electrolysis

A new process is presented for low-cost one-step production of pure solid silicon from natural quartzite by molten salt electrolysis. At a process temperature of 1100°C, a techno-economic model including detailed mass and energy balances estimates energy consumption below 15 kWh/kg, with operating cost of $\$1.74$/kg and capital cost around $\$10,500$ per t/a (tonne annually) of production capacity for a 160,000 t/a plant. Use of an inert solid oxide membrane anode results in a pure oxygen by-product and no direct emissions. As a result, finite element analysis estimates the current density distribution and total current to inform the design of slab-shaped solid silicon cathodes.

14 SOLAR ENERGY↗
DOE OSTI2021

Exploring the Role of Humidity, Temperature, and Mixed Ionic and Electronic Conductivity on SOFC Anode Electrocatalysis

Infiltration of nanoscale electrocatalysts into Ni/yttria-stabilized zirconia (Ni-YSZ) cermets has been shown to improve the electrochemical performance of solid oxide fuel cell (SOFC) anodes. While infiltrated electrodes in SOFCs result in improved cell performance, long-term operation leads to coarsening of the infiltrated nanoparticles and negates the short-term performance improvements. This study explores the roles of humidity, temperature, and number of cycles of nanocatalyst infiltration in improving mixed conduction within the Ni-YSZ electrode. Two mixed conduction phases were studied: Gd 0.1 Ce 0.9 O 2-δ (GDC) as an infiltrant into Ni-YSZ electrodes, and Ni/transition metal doped-YSZ electrodes infiltrated with Ni. Analysis of impedance data from these cells shows improved electrochemical performance in infiltrated cells with mixed conduction compared with infiltrated cells containing purely ionic and electronic conducting phases. Improved anode performance is attributed to the availability of electronic pathways through predominantly ionic-conducting phases to connect distant Ni nanoparticles and/or Ni grains.

25 ENERGY STORAGE↗
DOE OSTI2022

Quantifying the Relationship Between Microstructure and Performance in Gadolinium-Doped Ceria Infiltrated Ni/YSZ Symmetric Cells

Infiltration of mixed ionic/electronic conducting (MIEC) nanocatalysts into the anodes of solid oxide fuel cells (SOFCs) allow the hydrogen oxidation reaction (HOR) to occur at double-phase boundaries (DPBs), rather than being confined only to the triple phase boundaries (TPBs). In this research, we use a combination of cross-sectional scanning electron microscopy (SEM), three-dimensional (3-D) reconstruction, and electrochemical methods to characterize both baseline and gadolinium-doped ceria (GDC)-infiltrated symmetric cells, with the goal of establishing a comparison between the density of electrochemically active sites in uninfiltrated and GDC-infiltrated cells. Here, electrochemical impedance spectroscopy (EIS) and distribution of relaxation times (DRT) analysis showed GDC infiltration decreased the overall polarization of the anode by a factor of 8.78 X, and decreased the resistance associated with the reactions at the TPBs/DPBs by a factor of over 21 X. By quantifying expected GDC deposition morphology in the Ni/YSZ anode it is estimated that reactions occur in the baseline cell up to 84 nm from the active TPB lines.

36 MATERIALS SCIENCE↗
DOE OSTI2019

Novel Myocardial PET/CT Receptor Imaging and Potential Therapeutic Targets

Purpose of the Review: Activation of myocardial cannabinoid type 1 receptors (CB1-R) and/or angiotensin II type 1 receptors (AT1-R) likely plays an important mechanistic role in determining the left-ventricular remodeling process in systolic heart failure. We provide an overview on novel radiotracer probes and positron emission tomography (PET)/computed tomography (CT) imaging to noninvasively probe the expression of myocardial CB1-R and/or AT1-R. Recent Findings: Recent translational investigations have demonstrated the feasibility of {sup 11}C-OMAR or {sup 11}C-KR31173 and PET/CT to image and quantify myocardial CB1-R and/or AT1-R expression, respectively. There is an increasing understanding of the mechanisms of activated myocardial CB1-R and/or AT1-R to influence the left-ventricular remodeling process in systolic heart failure in different disease entities. Summary: The review summarizes contributions of PET to image myocardial CB1-R and AT1-R expression that may have the potential to serve as a target to tailor preventive medical care in the individual patient.

62 RADIOLOGY AND NUCLEAR MEDICINE↗
DOE OSTI2019

Multimodality imaging: Bird’s eye view from The European Society of Cardiology Congress 2018 Munich, August 25–29, 2018

At the European Society of Cardiology (ESC) congress of this year 2018, held in Munich from August 25th to 29th, 4594 abstracts were presented. Of those, 423 (10.8%) belonged to an imaging category. Experts in echocardiography (VD), cardiovascular magnetic resonance (CMR) (CBD), nuclear imaging (OG), and cardiac computed tomography (CT) (PMH) have selected the abstracts in their areas of expertise that were of most interest to them and are summarized in this bird’s eye view from this ESC meeting. These abstracts were integrated by one of the Editors of the Journal (JB).

62 RADIOLOGY AND NUCLEAR MEDICINE↗
DOE OSTI2017

On Delamination Toughening of a 14YWT Nanostructured Ferritic Alloy

The FCRD NFA-1 is a high strength, irradiation tolerant nanostructured ferritic alloy (NFA) produced by ball milling argon atomized Fe-14Cr-3W-0.35Ti-0.25Y (wt.%) and FeO powders, followed by hot extrusion at 850 °C, and subsequent annealing and cross-rolling at 1000 °C. The microstructure of the resulting ≈10 mm thick NFA-1 plate is dominated by ultrafine sub-micron pancake shaped grains, and a large population of microcracks lying on planes parallel to the plate faces. Pre-cracked fracture toughness tests in four different orientations (L-T, T-L, L-S and T-S) show stable crack growth by ductile tearing, with peak load K Jc from ≈ 88 to 154 MPa√m at ambient temperature. Stable crack tearing persists down to ≈ -175 °C and is accompanied by extensive delamination due to the propagation of the microcracks. Depending on the specimen orientation, this unusual toughening mechanism is either due to a reduction of crack tip stresses in thin ligaments formed by the delaminations (L-T and T-L), or 90° deflection of cracks initially running normal to the delaminations (L-S and T-S), thereby suppressing cleavage in both cases. Lastly, understanding the fracture processes in NFA-1 is also important to its irradiation tolerance in nuclear service as well as its fabricability in making defect-free components such as thin-walled tubing.

36 MATERIALS SCIENCE↗