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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 901 records · Page 50
All sourcesNASA NTRSDOE OSTI
DOE OSTI2018

Effect of melittin on water diffusion and membrane structure in DMPC lipid bilayers

Quasielastic neutron scattering (QENS) is well suited for studying the dynamics of water in proximity to supported membranes whose structure can be characterized by atomic force microscopy (AFM). Here we use QENS to investigate the effect of an adsorbed peptide (melittin) on water diffusion near a single-supported zwitterionic membrane (DMPC). Measurements of the incoherent elastic neutron intensity as a function of temperature provide evidence of bulk-like water freezing onto the melittin, which AFM images indicate coalesces into peptide-lipid domains as the peptide concentration increases. Analysis of the QENS spectra indicates that, at sufficiently high melittin concentrations, a water component diffusing more slowly than bulk-like water first freezes onto the bound melittin.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2018

Ultrafast molecular transport on carbon surfaces: The diffusion of ammonia on graphite

We present a combined experimental and theoretical study of the self-diffusion of ammonia on exfoliated graphite. Using neutron time-of-flight spectroscopy we are able to resolve the ultrafast diffusion process of adsorbed ammonia, NH 3 , on graphite. Together with van der Waals corrected density functional theory calculations we show that the diffusion of NH 3 follows a hopping motion on a weakly corrugated potential energy surface with an activation energy of about 4 meV which is particularly low for this type of diffusive motion. The hopping motion includes further a significant number of long jumps and the diffusion constant of ammonia adsorbed on graphite is determined with D = 3.9•10 -8 m 2 /s at 94 K.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2016

Role of Confinement on Adsorption and Dynamics of Ethane and an Ethane–CO 2 Mixture in Mesoporous CPG Silica

It was found that ethane is confined to mineral and organic pores in certain shale formations. Effects of confinement on structural and dynamic properties of ethane in mesoporous controlled pore glass (CPG) were studied by gravimetric adsorption and quasi-elastic neutron scattering (QENS) measurements. The obtained isotherms and scattering data complement each other by quantifying the relative strength of the solid–fluid interactions and the transport properties of the fluid under confinement, respectively. We used a magnetic suspension balance to measure the adsorption isotherms at two temperatures and over a range of pressures corresponding to a bulk density range of 0.01–0.35 g/cm 3 . Key confinement effects were highlighted through differences between isotherms for the two pore sizes. A comparison was made with previously published isotherms for CO 2 on the same CPG materials. Behavior of ethane in the smaller pore size was probed further using quasi-elastic neutron scattering. By extracting the self-diffusivity and residence time, we were able to study the effect of pressure and transition from gaseous to supercritical densities on the dynamics of confined ethane. Moreover, a temperature variation QENS study was also completed with pure ethane and a CO 2 –ethane mixture. Activation energies extracted from the Arrhenius plots show the effects of CO 2 addition on ethane mobility.

36 MATERIALS SCIENCE↗
DOE OSTI2018

Dynamics of Phospholipid Membranes beyond Thermal Undulations

Here, we investigated the molecular dynamics of unilamellar liposomes by neutron spin echo spectroscopy. We report the first experimental evidence of a short-range motion at the length scale of the size of the headgroup of a lipid. The associated mean squared displacement shows a t 0.26 dependence in the pico- to nanosecond region that indicates another process beyond the predictions of the Zilman–Granek (ZG) model (t 0.66 ) and translational diffusion (t 1 ). A comparison with theory shows that the observed low exponent is associated with a non-Gaussian transient trapping of lipid molecules in a local area and supports the continuous time random walk model. The analysis of the mean squared displacement leads to the important conclusion that the friction at the interface between water and liposomes plays a minor role. Center of mass diffusion of liposomes and transient trapping of lipids define the range in which the ZG model can be applied to analyze membrane fluctuations.

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

Enhanced superconductivity and ferroelectric quantum criticality in plastically deformed strontium titanate

The properties of quantum materials are commonly tuned using experimental variables such as pressure, magnetic field and doping. Here we explore a different approach using irreversible, plastic deformation of single crystals. We show that compressive plastic deformation induces low-dimensional superconductivity well above the superconducting transition temperature (Tc) of undeformed SrTiO3, with evidence of possible superconducting correlations at temperatures two orders of magnitude above the bulk Tc. The enhanced superconductivity is correlated with the appearance of self-organized dislocation structures, as revealed by diffuse neutron and X-ray scattering. We also observe deformation-induced signatures of quantum-critical ferroelectric fluctuations and inhomogeneous ferroelectric order using Raman scattering. Our results suggest that strain surrounding the self-organized dislocation structures induces local ferroelectricity and quantum-critical dynamics that strongly influence Tc, consistent with a theory of superconductivity enhanced by soft polar fluctuations. Our results demonstrate the potential of plastic deformation and dislocation engineering for the manipulation of electronic properties of quantum materials.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2022

PolyDODT: a macrocyclic elastomer with unusual properties

The effect of reaction conditions on the structure of poly(3,6-dioxa-1,8-octanedithiol) (polyDODT) made by Reversible Radical Recombination Polymerization (R3P) using triethylamine (TEA), H 2 O 2 and air was investigated. 800 MHz (1 and 2D) NMR was used to investigate the polymer structures. Sensitivity analysis provided direct evidence for high purity cyclic polyDODT up to M n ~ 100 000 g mol –1 . Here, comparative analysis by High Resolution Multidetector Size Exclusion Chromatography (SEC) using integrated data showed that the cycles had lower viscosity and were more compact (both for R g and R h ) than linear samples of similar molecular weight. However, differential data revealed unusual behavior. While lower molecular weight cyclic polymers eluted later and had lower intrinsic viscosity than their linear counterparts at the same molecular weight, at higher molecular weights the polymers showed strange behavior: both the diffusion coefficient measured by Quasielastic Light Scattering (QELS) and Mark–Houwink–Sakurada plots of intrinsic viscosity for linear and cyclic polyDODT were found to converge. R3P, an aqueous based “green” method is capable of producing polymers at the 10–100 g scale in the lab, which will allow more detailed studies of this new class of biodegradable elastomers so further experimentation can be performed to elucidate the reasons for the unusual findings.

36 MATERIALS SCIENCE↗
DOE OSTI2014

Metallic attenuated total reflection infrared hollow fibers for robust optical transmission systems

A durable metallic attenuated total reflection (ATR) hollow fiber (bore size: 1.45 mm, wall thickness: 50 μm) was designed and fabricated based on a nickel capillary tube and hexagonal germanium dioxide (GeO{sub 2}). The anomalous dispersion of the hexagonal GeO{sub 2} layer grown inside a nickel tube achieves low-loss light transmission at two peak-power wavelengths for CO{sub 2} laser devices (10.2 and 10.6 μm). An 11–28 W, 10.2 or 10.6 μm CO{sub 2} laser power was steadily delivered via a fiber elastically bent from 0° to 90° (radius: 45 cm) for over 40 min (transmission loss: 0.22 to 4.2 dB/m). Theoretically fitting the measured temperatures showed that front-end clipping caused greater thermal loading than the distributed mode absorption. The maximum external temperature of a nickel ATR fiber is much lower than that of a silica glass ATR fiber owing to their different heat dissipation abilities. The HE{sub 11} mode purity of the output beam profiles decreased from 90.3% to 44.7% as the bending angle increased from 0° to 90°. Large core sizes and wall roughnesses (scattering loss 0.04 dB/m) contributed to mode mixing and excess losses that were above the value predicted by the classical Marcatili and Schmeltzer equation (0.024–0.037 dB/m).

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2020

Utilisation of spatial derivative measurements in circular diffuse optical tomographic imaging to improve image resolution and contrast

The resolution of images recovered using diffuse optical tomography without spatial prior information is inherently limited due to the diffusive nature of light transport in scattering dominated biological tissue. Several studies have previously reported an improvement in depth sensitivity in near infrared spectroscopy by considering the subtraction of two neighbouring measurements. A nearest neighbour, spatial derivative based algorithm is presented, in which the difference between neighbouring source-sharing source – detector pairs is considered for tomographic reconstruction. Using a circular, inward-facing optode geometry, it is shown that deeper abnormalities in oxyhaemoglobin, deoxyhaemoglobin and water can be recovered with better localisation and contrast as compared to reconstructing using absolute values of multi-wavelength data. Relative improvements of up to 25 % in quantitative accuracy of recovered physiological values are demonstrated at better resolution for cancerous tissue in a heterogeneous breast model, when using this proposed spatial derivative based parameter reconstruction. (paper)

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2013

THE COSMIC INFRARED BACKGROUND EXPERIMENT (CIBER): THE LOW RESOLUTION SPECTROMETER

Absolute spectrophotometric measurements of diffuse radiation at 1 {mu}m to 2 {mu}m are crucial to our understanding of the radiative content of the universe from nucleosynthesis since the epoch of reionization, the composition and structure of the zodiacal dust cloud in our solar system, and the diffuse galactic light arising from starlight scattered by interstellar dust. The Low Resolution Spectrometer (LRS) on the rocket-borne Cosmic Infrared Background Experiment is a {lambda}/{Delta}{lambda} {approx} 15-30 absolute spectrophotometer designed to make precision measurements of the absolute near-infrared sky brightness between 0.75 {mu}m <{lambda} < 2.1 {mu}m. This paper presents the optical, mechanical, and electronic design of the LRS, as well as the ground testing, characterization, and calibration measurements undertaken before flight to verify its performance. The LRS is shown to work to specifications, achieving the necessary optical and sensitivity performance. We describe our understanding and control of sources of systematic error for absolute photometry of the near-infrared extragalactic background light.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2014

Interaction-induced backscattering in short quantum wires

We study interaction-induced backscattering in clean quantum wires with adiabatic contacts exposed to a voltage bias. Particle backscattering relaxes such systems to a fully equilibrated steady state only on length scales exponentially large in the ratio of bandwidth of excitations and temperature. Here in this paper we focus on shorter wires in which full equilibration is not accomplished. Signatures of relaxation then are due to backscattering of hole excitations close to the band bottom which perform a diffusive motion in momentum space while scattering from excitations at the Fermi level. This is reminiscent to the first passage problem of a Brownian particle and, regardless of the interaction strength, can be described by an inhomogeneous Fokker-Planck equation. From general solutions of the latter we calculate the hole backscattering rate for different wire lengths and discuss the resulting length dependence of interaction-induced correction to the conductance of a clean single channel quantum wire.

36 MATERIALS SCIENCE↗
DOE OSTI2026

Atomic structure and formation mechanism of a newly discovered charge density wave in the m = 2 monophosphate tungsten bronze

The m = 2 member of the monophosphate tungsten bronze family had been thought to be the only one without an electronic instability at low temperature. In this paper, we report the discovery of a charge density wave phase in this compound, with a transition temperature of 290 K and an incommensurate modulation vector q = 0.245b* + ξc*, which reaches a lock-in with a commensurate vector at 130 K. The presence of this new phase is confirmed by diffraction and resistivity measurements. Pre-transitional dynamics are investigated using diffuse and inelastic X-ray scattering, revealing a clear Kohn anomaly. We analyze both structural and electronic contributions to the phase transition, providing a comprehensive picture of the mechanism driving this newly identified instability.

Minelli, Arianna [ORNL] (ORCID:0000000283103712)↗
DOE OSTI2022

Pitch-Angle Diffusion in the Earth’s Magnetosphere Organized by the Mozer-Transformed Coordinate System

In the Earth’s dipole magnetosphere finite-gyroradius effects produce a shift of the atmospheric loss cone away from the direction of the magnetic field. This loss-cone shift is theoretically described by the “Mozer transform”, which is based upon the curvature drift of particles crossing the equatorial plane. For positive ions the northern and southern loss cones both shift westward and for electrons the northern and southern loss cones both shift eastward. This loss-cone shift is part of a coordinate-system transform, with the transformed coordinates better organizing the behavior of particle orbits in the dipole magnetic field (e.g. first adiabatic invariants, mirror heights, and bounce times). In this report it is demonstrated that the transformed coordinate system also properly organizes pitch-angle diffusion. This improved organization of the diffusion is true whether the angular scattering is produced by plasma-wave scattering or by field-line-curvature (FLC) scattering. It is shown that FLC scattering and the loss cone shift are linked, so that if FLC scattering is occurring, there is a loss cone shifted away from the magnetic-field direction and the Mozer-transformed coordinates are needed.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2018

Fluctuation Dynamo in a Collisionless, Weakly Magnetized Plasma

Results from a numerical study of fluctuation dynamo in a collisionless, weakly magnetized plasma are presented. The key difference between this dynamo and its magnetohydrodynamic (MHD) counterpart is the adiabatic production of magnetic-field-aligned pressure anisotropy by the amplification of a weak seed field. This, in turn, drives kinetic instabilities on the ion-Larmor scale—namely, firehose and mirror—which sever the adiabatic link between the thermal and magnetic pressures, thereby allowing the dynamo to proceed. After an initial phase of rapid growth driven by these instabilities, the magnetic energy grows exponentially and exhibits a ${k}^{3/2}$ spectrum that peaks near the resistive scale, similar to the large-magnetic-Prandtl-number ($\mathrm{Pm}\gg 1$) MHD dynamo. The magnetic field self-organizes into a folded-sheet topology, with direction reversals at the resistive scale and field lines curved at the parallel scale of the flow. The effective $\mathrm{Pm}$ is determined by whether the ion-Larmor scale is above or below the field-reversing scale: in the former case, particles undergo Bohm-like diffusion; in the latter case, particles scatter primarily off of firehose fluctuations residing at the ends of the magnetic folds, and the viscosity becomes anisotropic. The magnetic field ultimately saturates at dynamical strengths, with its spectral peak migrating toward larger scales. This feature, along with an anti-correlation of magnetic-field strength and field-line curvature and a gradual thinning of magnetic sheets into ribbons, resembles the saturated state of the large-$\mathrm{Pm}$ dynamo, the primary differences manifesting in firehose/mirror-unstable regions. Furthermore, these results have implications for magnetic-field growth in the weakly collisional intracluster medium of galaxy clusters.

79 ASTRONOMY AND ASTROPHYSICS↗
NASA NTRS1975

Mathematical formulation of scatter-free propagation of solar cosmic rays

The observations of strong persistent velocity anisotropies in solar flare events demand a mathematical theory closer to the extreme of scatter-free (deterministic) propagation rather than diffusive (stochastic) transport, since the latter breaks down as inferred mean-free-paths exceed 0.1 AU. Equations are derived for the time-dependent phase-space density, and Laplace transform techniques are used to obtain solutions under rather general conditions. The case of an Archimedean spiral field has been solved numerically, and the results compared with observations from Mariner and Explorer spacecraft of nearly 0.4 MeV proton intensity and anisotropy histories. These can both be replicated if the inner boundary of the modulation region is placed beyond 2 AU.

Nolte, J. T.↗