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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 865 records · Page 48
All sourcesNASA NTRSDOE OSTI
NASA NTRS2002

Ion Outflow Observations

The characteristics of out-flowing ions have been investigated under various circumstances. In particular the upwelling of ions from the cleft region has been studied to attempt to look at source characteristics (e.g., temperature, altitude). High altitude (6-8 Re) data tend to show ions species that have the same velocity and are adiabatically cooled. Such ions, while representative of their source, can not provide an accurate picture. Ion observations from the TIDE detector on the Polar spacecraft show an energy (or equivalently a velocity) spectrum of ions as they undo the geomagnetic mass spectrometer effect due to convection-gravity separation of the different species. Consolidation of this type of data into a complete representation of the source spectrum can be attempted by building a set of maximum-phase-space- density-velocity pairs and attributing the total to the source.

Mellot, Mary↗
DOE OSTI2020

Enabling high areal capacity for Co-free high voltage spinel materials in next-generation Li-ion batteries

The rapidly growing technological demand for lithium-ion batteries has prompted the development of novel cathode materials with high energy density, low cost, and improved safety. High voltage spinel, LiNi 0.5 Mn 1.5 O 4 (LNMO), is one of the most promising candidates yet to be commercialized. The two primary obstacles for this material are the inferior electronic conductivity and fast capacity degradation in full cells due to the high operating voltage. By systematically addressing these limitations, we successfully develop a thick LNMO electrode with areal capacity loadings up to 3 mAh·cm –2 . The optimized thick electrode is paired with a commercial graphite anode at both the coin cell and pouch cell level, achieving a full cell capacity retention as high as 72% and 78%, respectively, after 300 cycles. We attribute this superior cycling stability to careful optimizations of cell components and testing conditions, with a specific focus improving electronic conductivity and high voltage compatibility. These results suggest precise control of materials quality, electrode architecture and electrolyte optimization can soon support the development of a cobalt-free battery system based on a thick LNMO cathode (>4 mAh·cm 2 ), which will eventually meet the needs of next-generation Li-ion batteries with reduced cost, improved safety, and assured sustainability.

25 ENERGY STORAGE↗
DOE OSTI2026

Re-entrant unconventional superconductivity induced by rare-earth substitution in Nd 1-x Eu x NiO 2 thin films

High temperature superconductivity is typically associated with strong coupling and a large superconducting gap, yet these characteristics have not been demonstrated in the nickelates. Here, we provide experimental evidence that Eu substitution in the spacer layer of Nd 1-x Eu x NiO 2 (NENO) thin films enhances the superconducting gap, driving the system toward a strong-coupling regime. This is accompanied by a magnetic-exchange-driven magnetic-field-enhanced superconductivity. We investigate the upper critical magnetic field, H c2 , and the superconducting gap of superconducting NENO thin films with x = 0.2 to 0.35. Magnetoresistance measurements reveal magnetic-field-enhanced superconductivity in NENO films. We interpret this phenomenon as a result of an interaction between magnetic Eu ions and superconducting states in the Ni d x2-y2 orbital. The upper critical magnetic field strongly violates the weak-coupling Pauli limit. Infrared spectroscopy confirms a large gap-to-Tc ratio $2\Delta /{k}_{B}{T}_{{\rm{c}}}\simeq 5-6$, indicating a stronger coupling pairing mechanism in NENO relative to the Sr-doped NdNiO 2 . The substitution of Eu in the rare-earth layer causes pronounced modifications of the superconducting gap and magnetic interactions in Nd-based nickelates, opening new pathways to engineer high- T c superconductivity in infinite-layer nickelates.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Modeling gas–shell mixing in ICF with separated reactants

Mixing between fuel and shell materials in ICF implosions can affect implosion dynamics and even prevent ignition. We use data from a series of separated reactant experiments on the National Ignition Facility to calibrate and test the predictive power of gas–shell mix models. Two models are used to estimate fuel–shell mix: a Reynolds-averaged turbulence model and molecular diffusion. Minor uncertainties in capsule manufacture, experimental conditions, and values for mix model parameters produce significant variation in simulation results. Using input/output pairs from 1D simulations, we train Gaussian process surrogate models to predict experimental quantities of interest. The surrogates are used to construct posteriors for mix model parameters by marginalizing over uncertainties in capsule manufacture and experimental conditions. Mix models are calibrated with a subset of experimental data (neutron yields, ion temperature, and bang time) and tested using the remaining data. In general, both the diffusion and turbulence model correctly predict experimental DT and TT neutron yields. Despite having more free parameters, the turbulence model underpredicts ion temperature at high convergence ratio. Furthermore, the simpler diffusion model correctly predicts these temperatures, suggesting nonhydrodynamic gas–shell mix. The computational model consistently overpredicts DD neutron yield, indicating possible shortcomings outside of the mix model.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
NASA NTRS2016

Radiation Failures in Intel 14nm Microprocessors

In this study the 14 nm Intel Broadwell 5th generation core series 5005U-i3 and 5200U-i5 was mounted on Dell Inspiron laptops, MSI Cubi and Gigabyte Brix barebones and tested with Windows 8 and CentOS7 at idle. Heavy-ion-induced hard- and catastrophic failures do not appear to be related to the Intel 14nm Tri-Gate FinFET process. They originate from a small (9 m 140 m) area on the 32nm planar PCH die (not the CPU) as initially speculated. The hard failures seem to be due to a SEE but the exact physical mechanism has yet to be identified. Some possibilities include latch-ups, charge ion trapping or implantation, ion channels, or a combination of those (in biased conditions). The mechanism of the catastrophic failures seems related to the presence of electric power (1.05V core voltage). The 1064 nm laser mimics ionization radiation and induces soft- and hard failures as a direct result of electron-hole pair production, not heat. The 14nm FinFET processes continue to look promising for space radiation environments.

Microprocessors↗
DOE OSTI2023

Sodium Rich Vanadium Oxy‐Fluorophosphate – Na 3.2 Ni 0.2 V 1.8 (PO 4 ) 2 F 2 O – as Advanced Cathode for Sodium Ion Batteries

Abstract Conventional sodium‐based layered oxide cathodes are extremely air sensitive and possess poor electrochemical performance along with safety concerns when operating at high voltage. The polyanion phosphate, Na 3 V 2 (PO 4 ) 3 stands out as an excellent candidate due to its high nominal voltage, ambient air stability, and long cycle life. The caveat is that Na 3 V 2 (PO 4 ) 3 can only exhibit reversible capacities in the range of 100 mAh g −1 , 20% below its theoretical capacity. Here, the synthesis and characterizations are reported for the first time of the sodium‐rich vanadium oxyfluorophosphate, Na 3.2 Ni 0.2 V 1.8 (PO 4 ) 2 F 2 O, a tailored derivative compound of Na 3 V 2 (PO 4 ) 3 , with extensive electrochemical and structural analyses. Na 3.2 Ni 0.2 V 1.8 (PO 4 ) 2 F 2 O delivers an initial reversible capacity of 117 mAh g −1 between 2.5 and 4.5 V under the 1C rate at room temperature, with 85% capacity retention after 900 cycles. The cycling stability is further improved when the material is cycled at 50 °C within 2.8–4.3 V for 100 cycles. When paired with a presodiated hard carbon, Na 3.2 Ni 0.2 V 1.8 (PO 4 ) 2 F 2 O cycled with a capacity retention of 85% after 500 cycles. Cosubstitution of the transition metal and fluorine in Na 3.2 Ni 0.2 V 1.8 (PO 4 ) 2 F 2 O as well as the sodium‐rich structure are the major factors behind the improvement of specific capacity and cycling stability, which paves the way for this cathode in sodium‐ion batteries.

25 ENERGY STORAGE↗
DOE OSTI2022

Light-front holography model of the EMC effect

A new two-component model of the EMC effect based on Light-Front Holographic QCD (LFHQCD) is presented. The model suggests the EMC effect is the result of the nuclear potential breaking SU(6) symmetry. The model separates the $F_{2}^{A}$ nuclear structure function into two parts: a free contribution, involving the addition of proton and neutron structure functions weighted by the number of protons and neutrons respectively, and a nuclear/medium modified contribution that involves a universal function for all nuceli. Further, the model displays a connection with the correlation between the size of the EMC effect and the SRC pair density, a 2 - extracted from kinematic plateaus at around x > 1 in inclusive quasi-elastic (QE) scattering.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2020

Unexpected Hydroxide Ion Structure and Properties at Low Hydration

Understanding the behavior of hydroxide ions in aqueous and non-aqueous media is fundamental to many chemical, biological, and electrochemical processes. Research has primarily focused on a single fully solvated hydroxide ion, either as an isolated cluster or in bulk. This work presents the first computational study to consider hydroxide under low hydration levels in detail, where the anion may not be fully solvated. Under such conditions, we find that the anions are predominantly present as unique water-bridged hydroxide pair complexes, distinct from previously reported structures under fully hydrated conditions. Although similar hydroxide pair structures were previously reported, we analyze these structures for the first time in the disordered liquid state where they are found to be unusually stable in the presence of bulky quaternary ammonium cations. Our findings help explain the unusual diffusion behavior as well as the higher reactivity of hydroxide anions observed under low hydration conditions.

computational studies↗
DOE OSTI2020

Lithium degradation in lithium–sulfur batteries: insights into inventory depletion and interphasial evolution with cycling

The promise of high energy density lithium–sulfur batteries with long cycle life is currently tempered by the rapid degradation of lithium-metal anodes with cycling. An in-depth understanding of the dynamical behavior in liquid electrolytes, including the mechanisms underlying depletion of lithium inventory and evolution of lithium interphases, is crucial to make Li–S batteries a reality. We use here an anode-free full cell configuration, pairing a Li 2 S cathode with a bare nickel current collector with no lithium metal on it, to quantitatively estimate the lithium inventory loss per cycle. Lithium inventory loss is shown to be the main factor limiting the overall cyclability of Li–S batteries. Time-of-flight secondary ion mass spectrometry measurements on the deposited lithium reveal the presence of substantial metallic lithium even after most of the active lithium inventory has been depleted. The trapped metallic lithium is rendered electrochemically inactive by the growth of a resistive electrolyte decomposition interphase on the lithium surface. The bulk of the deposited lithium is shown to be composed of various fully reduced interphasial components, including several hydrogen-containing species that show a substantial reduction in intensity with cycling. This indicates considerable gas evolution and is also correlated with the loss of lithium inventory. The use of an anode-free full cell configuration provides a framework for accurate assessment of the dynamics of lithium inventory depletion and characterization of the accompanying interphasial evolution with cycling. The insights gained will prove invaluable to the development of strategies for extending the cycle life of energy-dense Li–S batteries.

25 ENERGY STORAGE↗
NASA NTRS1986

A storm time, Pc 5 event observed in the outer magnetosphere by ISEE 1 and 2 - Wave properties

The properties of the waves composing a classical storm time Pc 5 event, recorded by the satellite pair ISEE 1,2 during an inbound nearly equatorial pass in the dusk sector on August 21-22, 1978, are described. On the basis of these observations it is concluded that the events of the August 21-22 pass resulted from a combination of sources, namely, distant wideband excitation and ion drift instability, plus a coupling of wave modes. It is suggested that the observed phenomenon was a radial cross section of the type of event reported by Barfield et al. (1972).

Greenstadt, E. W.↗
NASA NTRS1994

Capillary electrophoresis: Biotechnology for separation of DNA and chromosomes

Electrophoresis has been used for the separation of particles, ions, and molecules for a number of years. The technology for separation and detection of the results has many applications in the life sciences. One of the major goals of the scientific community is to separate DNA molecules and intact chromosomes based upon their different lengths or number of base pairs. This may be achieved by using some of the commercially available and widely used methods, but these processes require a considerable amount of time. The challenge is to achieve separation of intact chromosomes in a short time, preferably in a matter of minutes.

Williams, George O., Jr.↗
DOE OSTI2023

Unveiling a high capacity multi-redox (Nb 5+ /Nb 4+ /Nb 3+ ) NASICON-Nb 2 (PO 4 ) 3 anode for Li- and Na-ion batteries

Sodium superionic conductor (NASICON)-type materials are widely explored as Li- and Na-ion cathodes and solid-state electrolytes but are largely ignored as anodes due to their lower capacities and higher intercalation voltages, which reduce the overall energy densities of Li- and Na-ion batteries (LIBs and SIBs). Herein, we unveil high capacity multi-redox empty NASICON-Nb 2 (PO 4 ) 3 as a potential anode material for LIBs and SIBs, which reversibly delivers 167 and 150 mA h g -1 at the average voltages of 1.86 V vs. Li + /Li 0 and 1.46 V vs. Na + /Na 0 , respectively. The Li and Na intercalation reactions proceed via multiple phase transitions, leading to short-range ordered Li 3 Nb 2 (PO 4 ) 3 and triclinic (P$\overline{1}$ with combining macron]) Na 3 Nb 2 (PO 4 ) 3 , as revealed by in situ X-ray diffraction studies. Our density functional theory calculations are also in agreement with the in situ measurements in predicting a stable Na 3 Nb 2 (PO 4 ) 3 composition in the Na–Nb 2 (PO 4 ) 3 pseudo-binary system. X-ray absorption spectroscopy confirms the participation of multi-redox Nb 5+ /Nb 4+ /Nb 3+ couples. The Nb 2 (PO 4 ) 3 anode delivers capacities greater than 124 and 106 mA h g -1 at 1C rate in Li and Na cells, respectively. In conclusion, pairing Nb 2 (PO 4 ) 3 with suitable cathodes and electrolytes can lead to high energy density batteries.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2024

Production of meson molecules in ultraperipheral heavy ion collisons

In this work we present a calculation of exotic charmonium production in ultraperipheral collisions, in which the exotic state is explicitly treated as a meson molecule. Our formalism is general, but we focus on the lightest possible exotic charmonium state: a 𝐷 + ⁢𝐷 − molecular bound state. It was proposed some time ago, and it has been an object of experimental searches. Here we study the production of the open charm pair in the process 𝛾⁢𝛾 → 𝐷 + ⁢𝐷 − . Then we use a prescription to project the free pair |𝐷 + ⁢𝐷 − ⟩ onto a bound state at the amplitude level and compute the cross section of the process 𝛾⁢𝛾 → 𝐵 (where 𝐵 is the bound state). Finally, we convolute this last cross section with the equivalent photon distributions coming from the projectile and target in an ultraperipheral collision and find the 𝐴⁢𝐴 → 𝐴⁢𝐴⁢𝐵 cross section, which, for 𝑃⁢𝑏 −𝑃⁢𝑏 collisions at $\sqrt{s_{NN}}$ =5.02 TeV, is of the order of 3 μ⁢b.

Sobrinho, F. C.↗
DOE OSTI2024

Thermal energy of a charm-meson molecule in a pion gas

The thermal corrections to the propagator of a loosely bound charm-meson molecule in a pion gas are calculated to next-to-leading order in the heavy-meson expansion using a zero-range effective field theory. Ultraviolet divergences in the charm-meson-pair self energy are canceled by corrections to the charm-meson-pair contact vertex. Terms that are singular at the charm-meson-pair threshold can be absorbed into thermal corrections to the rest energies and kinetic masses of the charm-meson constituents. The remaining terms reduce to a thermal correction to the binding momentum that is proportional to the pion number density and suppressed by the pion/charm-meson mass ratio. The correction gives a tiny decrease in the binding energy of the charm-meson molecule relative to the charm-meson-pair threshold in the pion gas and a change in its thermal width that is small compared to the thermal widths of the charm-meson constituents. These results are encouraging for the prospects of observing X(3872) and $T$$^{+}_{cc}$ (3875) in the expanding hadron gas produced by heavy-ion collisions.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2024

Symmetry-Breaking Charge Transfer in Metal–Organic Frameworks

High quantum-yield charge carrier generation from the initially prepared excitons defines a key step in the light-harvesting and conversion scheme. Photoinduced charge transfer in molecular electron donor—acceptor assemblies is driven by a sizable ΔG 0 , which compromises the potential of the generated carriers. Reminiscent of the special pair at the reaction center of the natural light-harvesting complex, symmetry-breaking charge transfer (SBCT) within a pair of identical struts of metal-organic framework (MOF) will facilitate the efficient generation of long-lived charge carriers with maximized potentials without incorporating any foreign redox species. We report SBCT in pyrene-based zirconium metal–organic framework (MOF) NU-1000 that leads to efficient generation of radical ions in a polar solvent and bound CT states in a low-polar solvent. Further, the probe unveils the role of the low-lying non-Franck–Condon excitonic states as intermediates in the formation of the SBCT state from the initially prepared Franck–Condon S 1 states. Ultrafast and transient spectroscopy—probed over 200 fs-30 μs time scale-evinces a k SBCT = (110 ps) -1 in polar media (ε s = 37.5) forming solvated radical ions with recombination rate k CR = (~45 ns) -1 . A slower rate with k SBCT = (203 ps) -1 was recorded in low-polar (ε s = 7.0) solvent manifesting a bound [TBAPy •+ TBAPy •– ] state with k CR ≈ (17 μs) -1 . This discovery, along with other unique photophysical features relevant to light harvesting, should define a MOF-based platform for developing heterogeneous artificial photon energy conversion systems.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2025

Energy dependence of polarized 𝛾⁢𝛾 → 𝑒 + ⁢ 𝑒− in peripheral Au+Au collisions at $\sqrt{s_{NN}}$ = 54.4 and 200 GeV with the STAR experiment at RHIC

We report the differential yields at mid-rapidity of the Breit-Wheeler process (𝛾⁢𝛾 → 𝑒 + ⁢𝑒 − ) in peripheral Au+Aucollisions at $\sqrt{s_{NN}}$ = 54.4 and 200 GeV with the STAR experiment at the Relativistic Heavy Ion Collider (RHIC), as a function of energy $\sqrt{s_{NN}}$, 𝑒 + ⁢𝑒 − transverse momentum 𝑝 T , 𝑝$^{2}_{T}$, invariant mass 𝑀 𝑒⁢𝑒 , and azimuthal angle. In the invariant mass range of 0.4 < 𝑀 𝑒⁢𝑒 < 2.6GeV/𝑐 2 at low transverse momentum (𝑝 T < 0.15GeV/𝑐), the yields increase while the pair √⟨𝑝$^{2}_{T}$⟩ decreases with increasing $\sqrt{s_{NN}}$, a feature that is correctly predicted by the QED calculation. Here, the energy dependencies of the measured quantities are sensitive to the nuclear form factor, infrared divergence and photon polarization. The data are compiled and used to extract the charge radius of the Au nucleus.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2025

Noise-aware circuit compilations for a continuously parameterized two-qubit gateset

State-of-the-art noisy-intermediate-scale quantum processors are currently implemented across a variety of hardware platforms, each with their own distinct gatesets. As such, circuit compilation should not only be aware of but also deeply connect to the native gateset and noise properties of each. Trapped-ion processors are one such platform that provides a gateset that can be continuously parameterized across both one- and two-qubit gates. Here we use the Quantum Scientific Computing Open User Testbed to study noise-aware compilations focused on continuously parameterized two-qubit 𝑍⁢𝑍 gates (based on the Mølmer-Sørensen interaction) using $\scriptsize{SUPERSTAQ}$, a quantum software platform for hardware-aware circuit compiler optimizations. We discuss the realization of 𝑍⁢𝑍 gates with arbitrary angle on the all-to-all connected trapped-ion system. Then we discuss a variety of different compiler optimizations that innately target these 𝑍⁢𝑍 gates and their noise properties. These optimizations include moving from a restricted maximally entangling gateset to a continuously parameterized one, swap mirroring to further reduce the total entangling angle of the operations, focusing the heaviest 𝑍⁢𝑍 angle participation on the best-performing gate pairs, and circuit approximation to remove the least impactful 𝑍⁢𝑍 gates. We demonstrate these compilation approaches on the hardware with randomized quantum volume circuits, observing the potential to realize a larger quantum volume as a result of these optimizations. Using differing yet complementary analysis techniques, we observe the distinct improvements in system performance provided by these noise-aware compilations and study the role of stochastic and coherent error channels for each compilation choice.

Noise↗