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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 1,189 records · Page 66
All sourcesNASA NTRSDOE OSTI
DOE OSTI2023

Laser-Induced Trapping of Metastable Amorphous AlO x /C (2.5 < x ≤ 3.5) Nanocomposites: Implications for Use as Solid Phase Gas Generators

The synthesis of kinetically "frozen" metastable nanostructures remains elusive. This limitation has severely restricted the current paradigms in materials discovery. We overcame this challenge by phase-stabilizing unusually hyperoxidized and metastable amorphous aluminum oxide (a-AlO x ; 2.5 < x ≤ 3.5) nanostructures. Specifically, we employed laser ablation synthesis in solution (LASiS) as a one-pot nonequilibrium technique to achieve this pivotal advancement. Structural and compositional characterizations of the as-synthesized material reveal highly disordered a-AlO x nanoparticles that are remarkably stabilized by interfacial monolayers of ordered carbon atoms. Both structure and chemical composition were confirmed with disparate characterization methods at different length scales. The nanoparticles of sizes less than10 nm were stable even at elevated temperatures. Only at temperatures higher than 750 °C do the a-AlO x structures undergo a solid-solid phase transition that culminates in the formation of stable α-Al 2 O 3 while releasing excess trapped gases. In conclusion, such disruptive materials can find applications in emerging technologies seeking metastable phase-change materials for solid phase gas generators, batteries, neuromorphic computing, and energetic additives.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2021

Structure, Magnetism, and First-Principles Modeling of the Na 0.5 La 0.5 RuO 3 Perovskite

High-purity polycrystalline Na 0.5 La 0.5 RuO 3 was synthesized by a solid-state method, and its properties were studied by magnetic susceptibility, heat capacity, and resistivity measurements. In this study, we find it to be an orthorhombic perovskite, in contrast to an earlier report, with random La/Na mixing. With a Curie–Weiss temperature of –231 K and an effective moment of 2.74 μB/mol Ru, there is no magnetic ordering down to 1.8 K. A broad hump at 1.4 K in the heat capacity, however, indicates the presence of a glassy magnetic transition, which we attribute to the influence of the random distribution of Na and La on the perovskite A-sites. Comparison to CaRuO 3 , a structurally ordered ruthenate perovskite with a similar A-site ionic radius and magnetic properties, is presented. First-principles calculations indicate that the Na–La distribution determines the local magnetic exchange interactions between Ru ions, favoring either antiferromagnetic or ferromagnetic coupling when the local environment is Na- or La-rich. Thus, our data and analysis suggest that mixing cations with different charges and sizes on the A-site in this perovskite results in magnetic frustration through a balance of local magnetic exchange interactions.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2023

Tunable Van Hove Singularity without Structural Instability in Kagome Metal $CsTi_{3}Bi_{5}$

In kagome metal $CsV_{3}Sb_{5}$, multiple intertwined orders are accompanied by both electronic and structural instabilities. These exotic orders have attracted much recent attention, but their origins remain elusive. The newly discovered $CsTi_{3}Bi_{5}$ is a Ti-based kagome metal to parallel $CsV_{3}Sb_{5}$. Here, in this work, we report angle-resolved photoemission experiments and first-principles calculations on pristine and Cs-doped $CsTi_{3}Bi_{5}$ samples. Our results reveal that the van Hove singularity (vHS) in $CsTi_{3}Bi_{5}$ can be tuned in a large energy range without structural instability, different from that in $CsV_{3}Sb_{5}$. As such, $CsTi_{3}Bi_{5}$ provides a complementary platform to disentangle and investigate the electronic instability with a tunable vHS in kagome metals.

36 MATERIALS SCIENCE↗
DOE OSTI2024

Score-based denoising for atomic structure identification

We propose an effective method for removing thermal vibrations that complicate the task of analyzing complex dynamics in atomistic simulation of condensed matter. Our method iteratively subtracts thermal noises or perturbations in atomic positions using a denoising score function trained on synthetically noised but otherwise perfect crystal lattices. The resulting denoised structures clearly reveal underlying crystal order while retaining disorder associated with crystal defects. Purely geometric, agnostic to interatomic potentials, and trained without inputs from explicit simulations, our denoiser can be applied to simulation data generated from vastly different interatomic interactions. The denoiser is shown to improve existing classification methods, such as common neighbor analysis and polyhedral template matching, reaching perfect classification accuracy on a recent benchmark dataset of thermally perturbed structures up to the melting point. Demonstrated here in a wide variety of atomistic simulation contexts, the denoiser is general, robust, and readily extendable to delineate order from disorder in structurally and chemically complex materials.

36 MATERIALS SCIENCE↗
DOE OSTI2021

Electron–phonon interaction in Kondo lattice systems

Highlights: • Rigorous study of ground state properties of the Kondo lattice model with an electron–phonon. • The ground state is proved to be unique. • The total spin of the ground state is determined according to the lattice structure. • Novel applications of order preserving operator inequalities. We study ground state properties of the Kondo lattice model with an electron–phonon interaction. The ground state is proved to be unique; in addition, the total spin of the ground state is determined according to the lattice structure. To prove the assertions, an extension of the method of spin reflection positivity is given in terms of order preserving operator inequalities.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2020

Ion Mobility Spectrometry with High Ion Utilization Efficiency Using Traveling Wave-Based Structures for Lossless Ion Manipulations

Ion packets introduced from gates, ion funnel traps, and other conventional ion injection mechanisms produce ion pulse widths typically around a few microseconds or less for ion mobility spectrometry (IMS)-based separations on the order of 100 milliseconds. When such ion injection techniques are coupled with ultralong path length traveling wave (TW)-based IMS separations (i.e., on the order of seconds) using structures for lossless ion manipulations (SLIMs), typically very low ion utilization efficiency is achieved for continuous ion sources [e.g., electrospray ionization (ESI)]. Even with the ability to trap and accumulate much larger populations of ions than being conventionally feasible over longer time periods in SLIM devices, the subsequent long separations lead to overall low ion utilization. In this study, we report the use of a highly flexible SLIM arrangement, enabling concurrent ion accumulation and separation and achieving near-complete ion utilization with ESI. We characterize the ion accumulation process in SLIM, demonstrate >98% ion utilization, and show both increased signal intensities and measurement throughput. This approach is envisioned to have broad utility to applications, for example, involving the fast detection of trace chemical species.

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

Structural, Optical, Dielectric, and Magnetic Characteristics of Nd Ions Substituted BaFe{sub 11}(Sn{sub 0.5}Mg{sub 0.5}){sub x}O{sub 19} M-Type Hexaferrite via Co-precipitation

Nanoparticles (NPs) of barium hexaferrite were synthesized by a chemical co-precipitation technique in an aqueous solution with a nominal composition of BaFe{sub 11}(Sn{sub 0.5}Mg{sub 0.5}){sub 1−x}Nd{sub x}O{sub 19} (x = 0, 0.5, 1). XRD and FTIR analyses were performed to study the crystal structure of the magnetic powders (MPs) in order to obtain details on the hexaferrite structure. Grain morphology and elemental composition were assessed by SEM and EDS, respectively, and nano-sized hexagonal platelet-like structures in all MPs were demonstrated. All of the structural parameters such as “a”, “c”, V{sub (cell)} and D{sub x} have been altered with successful incorporation of Nd into hexagonal lattices, thereby the band gap E{sub g} first increased x ≤ 0.5 then decreased up to x = 1 (i.e., drawn via a Tauc plot) from 1.53–1.82 eV. The measurements of dielectric properties depict relaxation behavior at higher frequencies. The dielectric measurements increase with increased hexaferrite. Furthermore, the magnetic properties of all MPs were examined by VSM at room temperature (RT). The saturation magnetization (M{sub s}), remnant magnetization (M{sub r}), and coercivity (H{sub c}) were linearly decreased by the SnMg content, whereas an increasing trend appeared with the additional Nd content. However, the squareness ratio increased with an increase in the content (x). These outcomes make this substitution an excellent candidate for multiple applications such as optical, electrical-based devices, circulators, and recording materials. .

77 NANOSCIENCE AND NANOTECHNOLOGY↗
NASA NTRS1985

Elevation Bearing Maximum Load, 70-meter Antenna

One of the preliminary frequency analyses of the 64-m antenna disclosed that considerable flexibility was attributable to the structure adjacent to the elevation bearings. In order to reduce this compliance, this adjacent structure and the bearings were made substantially larger. The result is that the stresses in these parts are small when used with the 64-m reflector and should remain sufficiently small when used with the larger 70-m reflector, which has an extended one-meter noise shield at its outer edge. The loads on the elevation bearings of the larger 70-m reflector are documented and these loads are compared to the corresponding ones of the 64-m antenna.

Mcginness, H. D.↗
NASA NTRS1995

Fine-Scale Filamentary Structure in Coronal Streamers

Doppler scintillation measurements of a coronal streamer lasting several solar rotations have been conducted by Ulysses in 1991 over a heliocentric distance range of 14-77 R(sub 0). By showing that the solar corona is filamentary, and that Doppler frequency is the radio counterpart of white-light eclipse pictures processed to enhance spatial gradients, it is demonstrated that Doppler scintillation measurements provide the high spatial resolution that has long eluded white-light coronagraph measurements. The region of enhanced scintillation, spanning an angular extent of 1.8 deg in heliographic longitude, coincides with the radially expanding streamer stalk and represents filamentary structure with scale sizes at least as small as 340 km (0.5 sec) when extrapolated to the Sun. Within the stalk of the streamer, the fine-scale structure corresponding to scale sizes in the range of 20-340 km at the Sun and associated with closed magnetic fields amounts to a few percent of the mean density, while outside the stalk, the fine-scale structure associated with open fields is an order of magnitude lower. Clustering of filamentary structure that takes place within the stalk of the streamer is suggestive of multiple current sheets. Comparison with ISEE 3 in situ plasma measurements shows that significant evolution resulting from dynamic interaction with increasing heliocentric distance takes place by the time streamers reach Earth orbit.

Woo, Richard↗
NASA NTRS2002

Efficient Reformulation of the Thermoelastic Higher-order Theory for Fgms

Functionally graded materials (FGMs) are characterized by spatially variable microstructures which are introduced to satisfy given performance requirements. The microstructural gradation gives rise to continuously or discretely changing material properties which complicate FGM analysis. Various techniques have been developed during the past several decades for analyzing traditional composites and many of these have been adapted for the analysis of FGMs. Most of the available techniques use the so-called uncoupled approach in order to analyze graded structures. These techniques ignore the effect of microstructural gradation by employing specific spatial material property variations that are either assumed or obtained by local homogenization. The higher-order theory for functionally graded materials (HOTFGM) is a coupled approach developed by Aboudi et al. (1999) which takes the effect of microstructural gradation into consideration and does not ignore the local-global interaction of the spatially variable inclusion phase(s). Despite its demonstrated utility, however, the original formulation of the higher-order theory is computationally intensive. Herein, an efficient reformulation of the original higher-order theory for two-dimensional elastic problems is developed and validated. The use of the local-global conductivity and local-global stiffness matrix approach is made in order to reduce the number of equations involved. In this approach, surface-averaged quantities are the primary variables which replace volume-averaged quantities employed in the original formulation. The reformulation decreases the size of the global conductivity and stiffness matrices by approximately sixty percent. Various thermal, mechanical, and combined thermomechanical problems are analyzed in order to validate the accuracy of the reformulated theory through comparison with analytical and finite-element solutions. The presented results illustrate the efficiency of the reformulation and its advantages in analyzing functionally graded materials.

Bansal, Yogesh↗
NASA NTRS1996

Oligomerization of uridine phosphorimidazolides on montmorillonite: a model for the prebiotic synthesis of RNA on minerals

The 5'-phosphorimidazolide of uridine reacts on Na(+)-montmorillonite 22A in aqueous solution to give oligomers as long as 7 mers. The maximum chain length increases to 9 mers and the overall oligomer yield increases when 9:1 ImpU, A5' ppA mixtures react under the same conditions. The oligomer yield and maximum chain length decreases with the structure of the added pyrophosphate in the order A5' ppA > A5' ppU > U5' ppU. Structure analysis of individual oligomer fractions was performed by selective enzymatic hydrolyses followed by HPLC analysis of the products. The regioselectivity for 3',5'-bond formation is 80-90% in the 9:1 ImpU, A5' ppA reaction, a percentage comparable to that observed in the 9:1 ImpA, A5' ppA reaction. Oligomerization of ImpU is inhibited by addition of dA5' ppdA, and MeppA. No oligomers containing A5' ppU were products of the 9:1 ImpU,A5' ppA reaction, a finding consistent with the simple addition of the ImpU to the A5' ppA and not the rearrangement of an ImpU-A5' ppA adduct. Concentrations of lysine or arginine which were close to that of the ImpU did not inhibit oligomer formation. Treatment of Na(+)-montmorillonite with 1 M arginine yielded arginine-montmorillonite, an amino acid-mineral adduct which did not catalyze ImpU oligomerization. Neither the 4-9 mers formed in the 9:1 ImpU, A5' ppA reaction nor the 4-9 mers formed by the base hydrolysis of poly(U) served as templates for the formation of oligo(A)s.

Non-NASA Center↗
DOE OSTI2025

Magnetic structure and magnetodielectric behavior of the chiral magnet CoTeMoO 6

We investigate the magnetic structure and magnetodielectric behavior of the chiral magnet CoTeMoO 6 (CTMO) through neutron diffraction, magnetization, and magnetodielectric measurements, complemented by density functional theory (DFT) calculations. Our findings reveal a canted magnetic structure with moments confined to the ab plane, giving rise to weak ferromagnetism under an external magnetic field. Additionally, we observe magnetodielectric coupling that strongly correlates with the magnetic ordering temperature and magnetic structure. Furthermore, these results are discussed in the context of potential mechanisms involving spin-dependent p-d hybridization and spin-phonon coupling.

Canted magnetism↗
NASA NTRS1982

Correlation of flight effects on centerline velocity decay for cold-flow acoustically excited jets

Acoustic excitation can influence the large scale shear layer structure of jet flow, thereby causing the jet centerline velocity to decay more rapidly. this phenomena has numerous practical applications, such as the reduction of jet/flap impingement velocity in order to reduce flap structural loads for under-the-wing STOL aircraft concepts. Cold flow centerline velocity decay data obtained with acoustic excitation of the jet exhaust flow are correlated with and without flight effects. Initially, static data are correlated in terms of an acoustic parameter involving the threshold sound level needed to initiate acoustic excitation of the jet plume. It is shown that for a given flight speed, the same acoustic excitation parameter as that developed for the static condition is valid. Finally, an aerodynamic flight effects parameter is included to correlate the static and flight centerline velocity decay data with and without acoustic excitation.

Vonglahn, U. H.↗
NASA NTRS1987

Pumping potential wells

Nonmonotonic plasma potential structures are a common feature of many double layers and sheaths. Steady state plasma potential wells separating regions having different plasma potentials are often found in laboratory experiments. In order to exist, such structures all must find a solution to a common problem. Ions created by charge exchange or ionization in the region of the potential well are electrostatically confined and tend to accumulate and fill up the potential well. The increase in positive charge should eliminate the well. Nevertheless, steady state structures are found in which the wells do not fill up. This means that it is important to take into account processes which 'pump' ions from the well. As examples of ion pumping of plasma wells, potential dips in front of a positively biased electro collecting anode in a relatively cold, low density multidipole plasma is considered. Pumping is provided by ion leaks from the edges of the potential dip or by oscillating the applied potential. In the former case the two dimensional character of the problem is shown to be important.

Hershkowitz, N.↗
NASA NTRS1989

Model reduction for flexible space structures

This paper presents the conditions under which modal truncation yields a near-optimal reduced-order model for a flexible structure. Next, a robust model reduction technique to cope with the damping uncertainties typical of flexible space structure is developed. Finally, a flexible truss and the COFS-1 structure are used to give realistic applications for the model reduction techniques studied in the paper.

Gawronski, Wodek↗
NASA NTRS1972

Application of composite materials to space shuttle tanks

Tanks are broken down into two categories: pressure vessels that carry primarily pressure loads, and structural tanks that carry structural loads such as thrust or bending in addition to pressure. A significant portion of the shuttle orbiter structure are tanks and in order to minimize both weight and cost growth on these shuttle tank structures, composite material tanks of both types are considered.

Faddoul, J. R.↗
NASA NTRS1989

New transformations between crystalline and amorphous ice

High-pressure optical and spectroscopic techniques were used to obtain directly the ice I(h) - hda-ice transformation in a diamond-anvil cell, and the stability of the amorphous form is examined as functions of pressure and temperature. It is demonstrated that hda-ice transforms abruptly at 4 GPa and 77 K to a crystalline phase close in structure to orientationally disordered ice-VII and to a more highly ordered, ice-VIII-like structure at higher temperatures. This is the first time that an amorphous solid is observed to convert to a crystalline solid at low temperatures by compression alone. Phase transitions of this type may be relevant on icy planetary satellites, and there may also be implications for the high-pressure behavior of silica.

Hemley, R. J.↗
NASA NTRS1989

Fabrication and evaluation of enhanced diffusion bonded titanium honeycomb core sandwich panels with titanium aluminide face sheets

A joining process was developed for fabricating lightweight, high temperature sandwich panels for aerospace applications using Ti-14Al-21Nb face sheets and Ti-3Al-2.5V honeycomb core. The process, termed Enhanced Diffusion Bonding (EDB), relies on the formation of a eutectic liquid through solid-state diffusion at elevated temperatures and isothermal solidification to produce joints in thin-gage titanium and titanium aluminide structural components. A technique employing a maskant on the honeycomb core was developed which permitted electroplating a controlled amount of EDB material only on the edges of the honeycomb core in order to minimize the structural weight and metallurgical interaction effects. Metallurgical analyses were conducted to determine the interaction effects between the EDB materials and the constituents of the sandwich structure following EDB processing. The initial mechanical evaluation was conducted with butt joint specimens tested at temperatures from 1400 - 1700 F. Further mechanical evaluation was conducted with EDB sandwich specimens using flatwise tension tests at temperatures from 70 - 1100 F and edgewise compression tests at ambient temperature.

Hoffmann, E. K.↗