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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 973 records · Page 54
All sourcesNASA NTRSDOE OSTI
NASA NTRS1979

The effect of energetically produced O2/+/ on the ion temperatures of the Martian thermosphere

The heating rates and ion temperatures of the Martian thermosphere resulting from the thermalization of the energetic O2(+) ions produced by the reactions of the solar ionization products CO2(+) and O(+) with neutral particles are calculated and the effects of small magnetic fields on the ion thermal balance are investigated. The energy transfer and transport of energetic ions is modelled by solving the continuity equation for the ions over a series of finite energy cells yielding the equilibrium densities as a function of energy and altitude. Particles which are able to proceed upwards without collisions are dealt with separately from the continuity equation. It is shown that the thermalization of the energetic O2(+) ions can greatly increase ion temperatures above 200 km compared to those calculated for only ambient electron heating. Current solar wind interaction models predict that small horizontal magnetic fields act to restrict the ion thermal conductivity and to increase upper altitude ion temperatures. The combined effects of these processes provide a partial agreement with measurements made by Viking 1.

Rohrbaugh, R. P.↗
DOE OSTI2023

Mixed quantum/classical theory for rotational energy exchange in symmetric-top-rotor + linear-rotor collisions and a case study of the ND 3 + D 2 system

The extension of mixed quantum/classical theory (MQCT) to describe collisional energy transfer is developed for a symmetric-top-rotor + linear-rotor system and is applied to ND 3 + D 2 . State-to-state transition cross sections are computed in a broad energy range for all possible processes: when both ND 3 and D 2 molecules are excited or both are quenched, when one is excited while the other is quenched and vice versa, when the ND 3 state changes its parity while D 2 is excited or quenched, and when ND 3 is excited or quenched while D 2 remains in the same state, ground or excited. In all these processes the results of MQCT are found to approximately satisfy the principle of microscopic reversibility. For a set of sixteen state-to-state transitions available from the literature for a collision energy of 800 cm –1 the values of cross sections predicted by MQCT are within 8% of accurate full-quantum results. A useful time-dependent insight is obtained by monitoring the evolution of state populations along MQCT trajectories. It is shown that, if before the collision, D 2 is in its ground state, the excitation of ND 3 rotational states proceeds through a two-step mechanism in which the kinetic energy of molecule–molecule collision is first used to excite D 2 and only then is transferred to the excited rotational states of ND 3 . Finally, it is found that both potential coupling and Coriolis coupling play important roles in ND 3 + D 2 collisions.

inelastic cross-sections↗
DOE OSTI2024

Discovery of orbital ordering in Bi 2 Sr 2 CaCu 2 O 8+x

The primordial ingredient of cuprate superconductivity is the CuO 2 unit cell. Theories usually concentrate on the intra-atom Coulombic interactions dominating the 3d 9 and 3d 10 configurations of each copper ion. However, if Coulombic interactions also occur between electrons of the 2p 6 orbitals of each planar oxygen atom, spontaneous orbital ordering may split their energy levels. This long-predicted intra-unit-cell symmetry breaking should generate an orbitally ordered phase, for which the charge transfer energy ε separating the 2p 6 and 3d 10 orbitals is distinct for the two oxygen atoms. Here we introduce sublattice-resolved ε(r) imaging to CuO 2 studies and discover intra-unit-cell rotational symmetry breaking of ε(r). Spatially, this state is arranged in disordered Ising domains of orthogonally oriented orbital order bounded by dopant ions, and within whose domain walls low-energy electronic quadrupolar two-level systems occur. Overall, these data reveal a Q = 0 orbitally ordered state that splits the oxygen energy levels by ~50 meV, in underdoped CuO 2 .

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2025

Probing exciton diffusion dynamics in photosynthetic supercomplexes via exciton–exciton annihilation

Photosynthesis converts solar energy into chemical energy through coordinated energy transfer between light-harvesting complexes and reaction centers (RCs). Understanding exciton motion, particularly the exciton diffusion length, is essential for optimizing energy efficiency in photosystems. In this work, we combine intensity-cycling transient absorption spectroscopy with kinetic Monte Carlo (kMC) simulation to investigate exciton motion in the C2S2 photosystem II supercomplex of spinach. Using exciton–exciton annihilation, revealed in the fifth-order response, we experimentally estimate an exciton diffusion length of 10.9 nm based on a 3D normal diffusion model, suggesting the ability of excitons to traverse the supercomplex. However, kMC simulations reveal that exciton motion is sub-diffusive because of spatial constraints and the strong RC traps. An anomalous diffusion model analysis of the experimental data yields a diffusion length of 9.7 nm, while the simulated diffusion length is 7.4 nm. The variable exciton residence time across subunits, partly influenced by their connectivity to the trap, indicates inhomogeneous annihilation probability and suggests how plants balance efficient light harvesting with photoprotection. We also explore the influence of specific assumptions in the annihilation simulation, which are challenging to access in more complex environments, such as the thylakoid membrane. Our study provides a framework for studying exciton dynamics using exciton–exciton annihilation, which can be extended to understand the light-harvesting efficiencies of larger, more complex photosynthetic assemblies.

Zhang, Kunyan (ORCID:000000026830409X)↗
DOE OSTI2026

The origin of metallic conductivity in Pt 3 O 4 : a first principles study

The platinum oxide Pt 3 O 4 exhibits metallic conductivity even though it contains square-planar PtO4 units, which in related oxides such as PtO are usually associated with insulating behavior. To identify the electronic origin of this anomalous metallicity, we performed a comprehensive first-principles study using the PBE and r 2 SCAN functionals together with Hubbard U corrections and spin-orbit coupling (SOC). Structural benchmarks show that r 2 SCAN with SOC and a moderate U value (<4 eV) reproduces the experimental lattice constants and formation enthalpy, whereas larger U values (~8 eV) destabilize the cubic structure. Across all functionals and U values considered in this work, Pt 3 O 4 remains metallic. Analyses of the projected density of states, band structures, charge-density isosurfaces, and bonding characteristics demonstrate that the dominant contribution to the metallic character originates from delocalized Pt–O–Pt hybridized antibonding states at the Fermi level. Direct Pt–Pt interactions are present but contribute less strongly to the conductivity. Bader charge analysis reveals only weak Pt charge disproportionation, consistent with mixed Pt II /Pt III character, and a small charge-transfer energy that prevents localization of the Pt 5d electrons even at elevated U. In contrast, PtO develops a Mott or charge-transfer gap under modest U despite having the same PtO 4 coordination environment. These findings demonstrate that persistent Pt–O–Pt covalency is the primary driver of metallicity in Pt 3 O 4 and support the view that this phase can remain conductive under oxygen reduction and oxygen evolution reaction conditions in fuel cell and electrolyzer environments.

36 MATERIALS SCIENCE↗
NASA NTRS1986

Turbulence in a convective marine atmospheric boundary layer

The structure and kinetic energy budget of turbulence in the convective marine atmospheric boundary layer as observed by aircraft during a cold air outbreak have been studied using mixed layer scaling. The results are significantly different from those of previous studies under conditions closer to free convection. The normalized turbulent kinetic energy and turbulent transport are about twice those found during the Air Mass Transformation Experiment (AMTEX). This implies that for a given surface heating the present case is dynamically more active. The difference is mainly due to the greater importance of wind shear in the present case. This case is closer to the roll vortex regime, whereas AMTEX observed mesoscale cellular convection which is closer to free convection. Shear generation is found to provide a significant energy source, in addition to buoyancy production, to maintain a larger normalized turbulent kinetic energy and to balance a larger normalized dissipation. The interaction between turbulent pressure and divergence (i.e., pressure scrambling) is also found to transfer energy from the vertical to the horizontal components, and is expected to be stronger in roll vortices than in m esoscale cells. The sensible heat flux is found to fit well with a linear vertical profile in a clear or subcloud planetary boundary layer (PBL), in good agreement with the results of Lenschow et al., (1980). The heat flux ratio between the PBL top and the surface, derived from the linear fitted curve, is approximately -0.14, in good agreement with that derived from the lidar data for the same case. Near the PBL top, the heat flux profiles are consistent with those of Deardoff (1979) and Deardorff et al. (1980).

Chou, S.-H.↗
NASA NTRS1993

Numerical simulation of shock/turbulent boundary layer interaction

Most flows of aerodynamic interest are compressible and turbulent. However, our present knowledge on the structures and mechanisms of turbulence is mostly based on incompressible flows. In the present work, compressibility effects in turbulent, high-speed, boundary layer flows are systematically investigated using the Direct Numerical Simulation (DNS) approach. Three-dimensional, time-dependent, fully nonlinear, compressible Navier-Stokes equations were numerically integrated by high-order finite-difference methods; no modeling for turbulence is used during the solution because the available resolution is sufficient to capture the relevant scales. The boundary layer problem deals with fully-turbulent compressible flows over flat geometries. Apart from its practical relevance to technological flows, turbulent compressible boundary layer flow is the simplest experimentally realizable turbulent compressible flow. Still, measuring difficulties prohibit a detailed experimental description of the flow, especially in the near-wall region. DNS studies provide a viable means to probe the physics of compressible turbulence in this region. The focus of this work is to explore the paths of energy transfer through which compressible turbulence is sustained. The structural similarities and differences between the incompressible and compressible turbulence are also investigated. The energy flow patterns or energy cascades are found to be directly related to the evolution of vortical structures which are generated in the near-wall region. Near-wall structures, and mechanisms which are not readily accessible through physical experiments are analyzed and their critical role on the evolution and the behavior of the flow is documented extensively.

Biringen, Sedat↗
NASA NTRS1999

Double Resonances and Spectral Scaling in the Weak Turbulence Theory of Rotating and Stratified Turbulence

In rotating turbulence, stably stratified turbulence, and in rotating stratified turbulence, heuristic arguments concerning the turbulent time scale suggest that the inertial range energy spectrum scales as k(exp -2). From the viewpoint of weak turbulence theory, there are three possibilities which might invalidate these arguments: four-wave interactions could dominate three-wave interactions leading to a modified inertial range energy balance, double resonances could alter the time scale, and the energy flux integral might not converge. It is shown that although double resonances exist in all of these problems, they do not influence overall energy transfer. However, the resonance conditions cause the flux integral for rotating turbulence to diverge logarithmically when evaluated for a k(exp -2) energy spectrum; therefore, this spectrum requires logarithmic corrections. Finally, the role of four-wave interactions is briefly discussed.

Rubinstein, Robert↗
NASA NTRS2016

Evidence Report: Risk of Radiation Carcinogenesis

As noted by Durante and Cucinotta (2008), cancer risk caused by exposure to space radiation is now generally considered a main hindrance to interplanetary travel for the following reasons: large uncertainties are associated with the projected cancer risk estimates; no simple and effective countermeasures are available, and significant uncertainties prevent scientists from determining the effectiveness of countermeasures. Optimizing operational parameters such as the length of space missions, crew selection for age and sex, or applying mitigation measures such as radiation shielding or use of biological countermeasures can be used to reduce risk, but these procedures have inherent limitations and are clouded by uncertainties. Space radiation is comprised of high energy protons, neutrons and high charge (Z) and energy (E) nuclei (HZE). The ionization patterns and resulting biological insults of these particles in molecules, cells, and tissues are distinct from typical terrestrial radiation, which is largely X-rays and gamma-rays, and generally characterized as low linear energy transfer (LET) radiation. Galactic cosmic rays (GCR) are comprised mostly of highly energetic protons with a small component of high charge and energy (HZE) nuclei. Prominent HZE nuclei include He, C, O, Ne, Mg, Si, and Fe. GCR ions have median energies near 1 GeV/n, and energies as high as 10 GeV/n make important contributions to the total exposure. Ionizing radiation is a well known carcinogen on Earth (BEIR 2006). The risks of cancer from X-rays and gamma-rays have been established at doses above 50 mSv (5 rem), although there are important uncertainties and on-going scientific debate about cancer risk at lower doses and at low dose rates (<50 mSv/h). The relationship between the early biological effects of HZE nuclei and the probability of cancer in humans is poorly understood, and it is this missing knowledge that leads to significant uncertainties in projecting cancer risks during space exploration (Cucinotta and Durante 2006; Durante and Cucinotta 2008).

Huff, Janice↗
DOE OSTI2022

Charge Symmetry Violation Quark Distributions Via Precise Measurement of p+/p- Rations in Semi-Inclusive Deep Inelastic Scattering

Charge symmetry in the nucleon parton distributions assumes the distribution of quarks in the proton is related to those in the neutron. Indirect experimental evidence constrains Charge Symmetry Violation (CSV) to be less than 9%. In Quantum Chromo-Dynamics (QCD), charge symmetry is broken by the mass difference between the up and down quarks. CSV in the valence region can be extracted from precision measurements of the cross section ratio of charged pion production in semi-inclusive deep inelastic scattering (SIDIS) from deuterium. Such measurements were proposed and carried out in experiment E12-09-002 at Jefferson Lab. The experiment was conducted in Hall C from fall 2018 to spring 2019 using the upgraded 10.6 GeV incident electron beam. In this SIDIS experiment, charged pions are detected in coincidence with scattered electrons covering the four-momentum transfer of the virtual photon Q2 from 4 to 5.5 GeV2, the Bjorken variable x for 0.35-0.65, and the fraction of energy transfer carried by the outgoing pion z from 0.4-0.7.

Jia, Shuo↗
NASA NTRS1967

High-energy-rate magnetohydraulic metal forming system

In the magnetohydraulic metal forming system, a sonic shock wave is generated in a liquid medium by a coil energized by an electrical discharge. These waves transfer energy from a metal diaphragm, actuated by a pulsed magnetic field, to a metal workpiece. In the development a study was made of the pressure pulse phenomenon in a liquid medium.

Source record↗
DOE OSTI2024

Hybrid direct drive with a two-sided ultraviolet laser

This paper presents a “hybrid” approach to direct drive inertial confinement fusion that can exploit a high-energy gas laser with two opposed beams. The target and driver are asymmetric, much like experiments performed on the National Ignition Facility, but have been designed to benefit from scale and their particular compatibility with a fusion power plant. The imploded masses (and areal densities) are increased by a factor of 12 (3) and provide a path to high-gain implosions that robustly ignite. The design also mitigates common concerns such as laser imprint and cross-beam energy transfer. We discuss the rationales for a hybrid target, the methods used to control implosion symmetry, and the implication(s) for inertial fusion energy.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2026

Size scaling of acceleration phase energetics and its effects on direct-drive DT-layered implosions

A fundamental question in inertial confinement fusion is how implosion performance, and therefore ignition thresholds and fusion gain, evolve with target size. In laser-driven direct drive fusion, the scaling of laser-drive performance with size is critical to this evolution and to extrapolating results from the 30-kJ OMEGA laser-fusion experiments to ignition-class facilities such as the National Ignition Facility. Beyond the well-known adverse effects of cross-beam energy transfer (CBET) on drive performance, here we demonstrate that effects related to the non-scaling physics of thermal conduction and electron–ion energy equilibration exert an influence on drive behavior with scale that equals or surpasses that of CBET. We find that a significant portion of the lost implosion performance with increasing scale is due to the loss of shell implosion velocity. Here, we show that while modest modifications to hydro-scaled designs can recover most of the lost implosion velocity, a full hydro-equivalent performance extrapolation is difficult to achieve without CBET mitigation or subcooling below the triple point of DT.

Patel, D. [University of Rochester, NY (United Sta↗
DOE OSTI2021

As a Matter of Tension: Kinetic Energy Spectra in MHD Turbulence

While magnetized turbulence is ubiquitous in many astrophysical and terrestrial systems, our understanding of even the simplest physical description of this phenomena, ideal magnetohydrodynamic (MHD) turbulence, remains substantially incomplete. As such, in this work we highlight the shortcomings of existing theoretical and phenomenological descriptions of MHD turbulence that focus on the joint (kinetic and magnetic) energy fluxes and spectra by demonstrating that treating these quantities separately enables fundamental insights into the dynamics of MHD turbulence. This is accomplished through the analysis of the scale-wise energy transfer over time within an implicit large eddy simulation of subsonic, super-Alfvénic MHD turbulence. Our key finding is that the kinetic energy spectrum develops a scaling of approximately k –4/3 in the stationary regime as magnetic tension mediates large-scale kinetic to magnetic energy conversion and significantly suppresses the kinetic energy cascade. This motivates a reevaluation of existing MHD turbulence theories with respect to a more differentiated modeling of the energy fluxes.

79 ASTRONOMY AND ASTROPHYSICS↗
NASA NTRS1991

LET analyses of biological damage during solar particle events

The effects of nuclear reactions on integral low-linear-energy-transfer (LET) protons spectra are studied, behind typical levels of spacecraft and body shielding, for the historically largest flares using the high-energy transport code BRYNTRN in conjunction with several biological damage models. The cellular track model of Katz provides an accurate description of cellular damage from heavy ion exposure. The track model is applied with BRYNTRN to provide a LET decomposition of survival and transformation rates for solar proton events. In addition, a fluence-based risk coefficient formalism is used to estimate Harderian gland-tumor induction in rodents and cataractogenesis in rabbits from solar flares, and a LET analysis is used to assess the relative contribution from target fragments on these biological endpoints.

Cucinotta, Francis A.↗
DOE OSTI2025

Using Light to Enhance Charge Transfer in Battery Materials: Increasing Charging Rates in LiNi 0.5 Mn 1.5 O 4

Electrochemical, spectroscopic, and computational studies on the interplay between light perturbation and coupled electron and Li-ion transfer in LiNi 0.5 Mn 1.5 O 4 (LNMO) cathodes identify that photon perturbation moves the system out of equilibrium, increases entropy, lowers the impedance of the battery, and increases the charging capacity by at least 15% during fast charging by promoting the oxidation of Ni 3+ to Ni 4+ . Here, the correlation with density functional theory calculations points out that oxidation of Ni 3+ faces a 30% higher barrier compared with the oxidation of Ni 2+ and hence exhibits greater responses to the energy transferred from photons. Structural analysis elucidates that photon energy also assists the transition of LNMO from the Jahn−Teller distorted asymmetric lattice with Ni 3+ to the nondistorted Ni 4+ . Synergistically, photons energize the removal of electrons from Ni 3+ and create photoinduced Ni 4+ intermediates, followed by the removal of Li + with almost two times faster diffusion rates.

5 V spinel↗
DOE OSTI2020

Balancing Charge Transfer and Frenkel Exciton Coupling Leads to Excimer Formation in Molecular Dimers: Implications for Singlet Fission

Photoexcitation of molecular chromophore aggregates can form excimer states that play a significant role in photophysical processes such as charge and energy transfer as well as singlet fission. An excimer state is commonly defined as a superposition of Frenkel exciton and charge transfer states. In this work, we investigate the dynamics of excimer formation and decay in π-stacked 9,10-bis(phenylethynyl)anthracene (BPEA) covalent dimers appended to a xanthene spacer, where the electronic coupling between the two BPEA molecules is adjusted by changing their longitudinal molecular slip distances. Using exciton coupling calculations, we quantify the relative contributions of Frenkel excitons and charge transfer states and find that there is an upper and lower threshold of the charge transfer contribution for efficient excimer formation to occur. In conclusion, knowing these thresholds can aid the design of molecular aggregates that optimize singlet fission.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
NASA NTRS1984

Applications of space tethers

The dynamics of orbiting tethered bodies are reviewed and several practical aplications are examined. Two tethered masses in orbit will seek a local vertical orientation and a stable equilibrium, with energy transferred to the 'upper' object. The tether tensions are provided by accelerations as low a 0.0004 g., permitting long tethers an relatively large masses at the ends. The Shuttle can send a payload into a transfer orbit by placing it at the upper end of the tether, unreeling the tether, then releasing the tether and thereby imparting the excess energy to the satellite while the Orbiter falls to a lower perigee. A 10 ton payload could be unreeled on a 148 km tether, released to a 12 n. mi. apogee, and the Orbiter would be in full deorbit. Similarly, the Orbiter can tether down to deorbit form the Space Station, boosting the Station to a higher orbit. The station can then unreel a large satellite, release it to a higher orbit, thereby returning to the stations original orbit. Unreeling a wire 10 km from the Space station and having the wire cut the earth's magnetic field lines, then closing the contact between the upward and lower ends of the wire, can, with modifications, either provide power or thrust without propellants for the Station.

Bekey, I.↗