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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 919 records · Page 51
All sourcesNASA NTRSDOE OSTI
DOE OSTI2023

Comparison of the Chemical Composition of Liquids from the Pyrolysis and Hydrothermal Liquefaction of Lignocellulosic Materials

Major differences in thermal stability and hydrotreatment behavior of HTL and pyrolysis oils have been reported in the literature. However, little is known about the variations in the chemical composition of these oils that could explain such differences. Two commercial wood pyrolysis oils (Pyrovac and BTG), and their water-soluble (WS) and water-insoluble fractions (WIS) were analyzed and compared with the aqueous (WS WD-57 ) and oily (WIS WS-57 ) fractions obtained from hydrothermal liquefaction (HTL) of Douglas-fir. The samples were characterized by GC/MS, Karl Fischer titration, carbonyl content, total acid number, elemental composition, calorific value, proximate analysis, Fourier Transform Infrared Spectroscopy (FTIR), Folin-Ciocalteu (FC), and UV fluorescence. All the fractions were also analyzed by Fourier Transform Ion Cyclotron Resonance Mass Spectroscopy (FT-ICR-MS) and by Electrospray Ionization (EI). The most prevalent class of compounds in the water insoluble phases were phenols derived from lignin. Water-soluble phases contain mostly the oxygenated compounds derived from cellulose and hemicellulose and were richer in carbonyl functional groups. The water content of the resulting aqueous phases were between: 65 (WS BTG ) and 96 (WS Pyrovac ) wt. %. The bio-oil from BTG has higher water content and lower HHV, compared to Pyrovac oil. The GC/MS results of BTG oil show the presence of a more prominent acetic acid peak and higher TAN number than the Pyrovac oil. The GC/MS of Pyrovac oil showed more obvious mono-phenol peaks. The quantification of this family by Folin-Ciocalteu method confirmed higher content of monophenolic compounds compared with the BTG oil. The lower thermal stability of pyrolysis oils compared with HTL biocrudes can be partially explained by the fact that pyrolysis oils (BTG and Pyrovac) contain carbohydrates while HTL biocrude (WIS WD-57 ) doesn’t. Thus, we decided to further investigate the chemical differences between the phenolic rich fractions insoluble in water and the holocellulose derived compounds soluble in water. Even after water extraction, the acid content of the water insoluble fraction from BTG (WISBTG) was higher than the acid content of the water insoluble fraction obtained by HTL (WISWSD-57). Likewise, the acid content of the aqueous phases derived from pyrolysis oils (WS Pyrovac , WS BTG ) was also higher than for the aqueous phase obtained by HTL (WSWSD-57). This result is in part due to the use of bases in the HTL process that neutralizes the acid formed in that process. Moreover, the starting feedstock may also influence the differences between the oils. Although, the UV-Fluorescence spectra, ICR-MS and the EI analyses showed some minor differences in the molecular weight and chemical make-up of the oligomers soluble and insoluble in water from pyrolysis and HTL; the differences observed were not large enough to justify the differences in behavior between these oils reported in the literature. Our results suggest that the differences observed between HTL biocrudes and pyrolysis oils are likely partially due to the presence of holocellulose derived products in the pyrolysis oils and higher acid contents.

09 BIOMASS FUELS↗
DOE OSTI2018

Dynamic conductivity and partial ionization in dense fluid hydrogen

A theoretical description for the optical conduction experiments in dense fluid hydrogen is presented. Different quantum statistical approaches are used to describe the mechanism of electronic transport in hydrogen’s high-temperature dense phase. In this work, we show that at the onset of the metallic transition, optical conduction could be described by a strong rise in the atomic polarizability because of increased ionizations, whereas in the highly degenerate limit, the Ziman weak-scattering model better accounts for the observed saturation of reflectance. The inclusion of the effects of partial ionization in the highly degenerate region provides excellent agreement with experimental results. Hydrogen’s fluid metallic state is revealed to be a partially ionized free-electron plasma. Our results provide some of the first theoretical models that are experimentally benchmarked, as well as an important guide for future studies.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2018

Ultrafast Shock-Induced Reactions in Pentaerythritol Tetranitrate Thin Films

The chemical and physical processes involved in the shock-to-detonation transition of energetic solids are not fully understood due to difficulties in probing the fast dynamics involved in initiation. Here, we employ shock interferometry experiments with sub-20-ps time resolution to study highly textured (110) pentaerythritol tetranitrate (PETN) thin films during the early stages of shock compression using ultrafast laser-driven shock wave methods. We observe evidence of rapid exothermic chemical reactions in the PETN thin films for interface particle velocities above ~1.05 km/s as indicated by shock velocities and pressures well above the unreacted Hugoniot. The time scale of our experiment suggests that exothermic reactions begin less than 50 ps behind the shock front for these high-density PETN thin films. Thermochemical calculations for partially reacted Hugoniots also support this interpretation. Finally, the experimentally observed time scale of reactivity could be used to narrow possible initiation mechanisms.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2022

Physics constrained learning for data-driven inverse modeling from sparse observations

Deep neural networks (DNN) have been used to model nonlinear relations between physical quantities. Those DNNs are embedded in physical systems described by partial differential equations (PDE) and trained by minimizing a loss function that measures the discrepancy between predictions and observations in some chosen norm. This loss function often includes the PDE constraints as a penalty term when only sparse observations are available. As a result, the PDE is only satisfied approximately by the solution. However, the penalty term typically slows down the convergence of the optimizer for stiff problems. We present a new approach that trains the embedded DNNs while numerically satisfying the PDE constraints. We develop an algorithm that enables differentiating both explicit and implicit numerical solvers in reverse-mode automatic differentiation. This allows the gradients of the DNNs and the PDE solvers to be computed in a unified framework. We demonstrate that our approach enjoys faster convergence and better stability in relatively stiff problems compared to the penalty method. Furthermore, our approach allows for the potential to solve and accelerate a wide range of data-driven inverse modeling, where the physical constraints are described by PDEs and need to be satisfied accurately.

97 MATHEMATICS AND COMPUTING↗
NASA NTRS2019

Modeling Mg II During Solar Flares. I. Partial Frequency Redistribution, Opacity, and Coronal Irradiation

The Interface Region Imaging Spectrograph has routinely observed the flaring Mg II near-ultraviolet (NUV) spectrum, offering excellent diagnostic potential and a window into the location of energy deposition. A number of studies have forward-modeled both the general properties of these lines and specific flare observations. Generally these have forward-modeled radiation via post-processing of snapshots from hydrodynamic flare simulations through radiation transfer codes. There has, however, not been a study of how the physics included in these radiation transport codes affects the solution. A baseline setup for forward-modeling Mg II in flares is presented and contrasted with approaches that add or remove complexity. It is shown for Mg II that (1) partial frequency distribution (PRD) is still required during flare simulations despite the increased densities; (2) using full angle-dependent PRD affects the solution but takes significantly longer to process a snapshot; (3) including Mg I in non-LTE (NLTE) results in negligible differences to the Mg II lines but does affect the NUV quasi-continuum; (4) only hydrogen and Mg II need to be included in NLTE; (5) ideally the nonequilibrium hydrogen populations, with nonthermal collisional rates, should be used rather than the statistical equilibrium populations; (6) an atom consisting of only the ground state, h and k upper levels, and continuum level is insufficient to model the resonance lines; and (7) irradiation from a hot, dense flaring transition region can affect the formation of Mg II. We discuss modifications to the RH code allowing straightforward inclusion of the transition region and coronal irradiation in flares.

Kerr, Graham S.↗
DOE OSTI2014

Variability of the high-velocity outflow in the quasar PDS 456

We present a comparison of two Suzaku X-ray observations of the nearby (z = 0.184), luminous (L {sub bol} ∼ 10{sup 47} erg s{sup –1}) type I quasar, PDS 456. A new 125 ks Suzaku observation in 2011 caught the quasar during a period of low X-ray flux and with a hard X-ray spectrum, in contrast with a previous 190 ks Suzaku observation in 2007 when the quasar appeared brighter and had a steep (Γ > 2) X-ray spectrum. The 2011 X-ray spectrum contains a pronounced trough near 9 keV in the quasar rest frame, which can be modeled with blueshifted iron K-shell absorption, most likely from the He- and H-like transitions of iron. The absorption trough is observed at a similar rest-frame energy as in the earlier 2007 observation, which appears to confirm the existence of a persistent high-velocity wind in PDS 456, at an outflow velocity of 0.25-0.30c. The spectral variability between 2007 and 2011 can be accounted for by variations in a partial covering absorber, increasing in covering fraction from the brighter 2007 observation to the hard and faint 2011 observation. Overall, the low-flux 2011 observation can be explained if PDS 456 is observed at relatively low inclination angles through a Compton-thick wind, originating from the accretion disk, which significantly attenuates the X-ray flux from the quasar.

79 ASTRONOMY AND ASTROPHYSICS↗
NASA NTRS1986

Interiors of the giant planets

The interior structure of the Jovian planets was studied by means of observational data obtained by ground-based astronomy. Recent work was oriented toward a determination of oblateness from occultation measurements of the shape of planetary atmospheres. This provides a determination of the degree of central condensation of the planet, which is then compared with interior models and theoretical equations of state. As a serendipitous result of the attempts to measure the oblateness of Neptune, a partial Neptune ring (or arc) was discovered following an occultation observation on July 22, 1984. During 1985, older observations were reexamined to determine whether Neptune arcs had been detected (but not identified) during previous occultations. It appears that Neptunian arcs may locally imitate Uranian rings, with an 1981 event resembling Uranus' epsilon ring, while an 1984 event was more similar to the thinner Uranian rings such as the alpha ring.

Hubbard, W. B.↗
DOE OSTI2025

Measurement of the properties of the dust acoustic wave in a magnetic field

We present the first experimental observations of the dust acoustic wave where the wave was observed to propagate in the directions of gravity and magnetic field when these directions were not aligned. The experiments were conducted in the Magnetized Dusty Plasma eXperiment facility using a novel electrode system that allows for the angle between gravity and the magnetic field to be varied in a controlled way. This letter reports on measurements in an rf glow discharge argon plasma environment where the angle between direction of gravity and the magnetic field is 45 $^{\circ }$ . When there was no applied magnetic field, the wave was observed to propagate in the direction of gravity. However, as the magnetic field increased and the ions transitioned from flowing in the direction of gravity to the direction of the magnetic field, a second wave emerged and two distinct waves were observed to simultaneously propagate, one in the direction of gravity and one in the direction of the magnetic field. As the magnetic field was further increased, the wave that propagated in the direction of gravity was suppressed and the wave was only observed to propagate in the direction of the applied magnetic field. We also observe that the speed and the kinetic temperature of the dust for the mode that propagated in the direction of gravity decreased with increasing magnetic field while the speed and the kinetic temperature of the dust for the mode that propagated in the direction of the magnetic field increased with increasing magnetic field. These measurements suggest that an ion-dust streaming instability is at least partially responsible for the high temperatures that have previously been observed in dusty plasmas when the dust acoustic wave is present.

Williams, J. D. (ORCID:000000025199707X)↗
DOE OSTI2020

Steam oxidation of ytterbium disilicate environmental barrier coatings with and without a silicon bond coat

The current generation of multilayer Si/Yb 2 Si 2 O 7 environmental barrier coatings (EBCs) are temperature limited by the melting point of Si, 1414°C. To investigate higher temperature EBCs, the cyclic steam oxidation of EBCs comprised of a single layer of ytterbium disilicate (YbDS) was compared to multilayered Si/YbDS EBCs, both deposited on SiC substrates using atmospheric plasma spray. In this work, after 500 1-h cycles at 1300°C in 90 vol%H2O-10 vol%air with a gas velocity of 1.5 cm/s, both multilayer Si/YbDS and single layer YbDS grew thinner silica scales than bare SiC, with the single layer YbDS forming the thinnest scale. Both coatings remained fully adherent and showed no signs of delamination. Silica scales formed on the single layer coating were significantly more homogeneous and possessed a markedly lower degree of cracking compared to the multilayered EBC. The single layer EBC also was exposed at 1425°C in steam with a gas velocity of 14 cm/s in an alumina reaction tube. The EBC reduced specimen mass loss compared to bare SiC but formed an extensive 2nd phase aluminosilicate reaction product. A similar reaction product was observed to form on some regions of the bare SiC specimen and appeared to partially inhibit silica volatilization. The 1425°C steam exposures were repeated with a SiC reaction tube and no 2nd phase reaction product was observed to form on the single layer EBC or bare SiC.

36 MATERIALS SCIENCE↗
DOE OSTI2015

POLARIZED LINE FORMATION IN MOVING ATMOSPHERES WITH PARTIAL FREQUENCY REDISTRIBUTION AND A WEAK MAGNETIC FIELD

The dynamical state of the solar and stellar atmospheres depends on the macroscopic velocity fields prevailing within them. The presence of such velocity fields in the line formation regions strongly affects the polarized radiation field emerging from these atmospheres. Thus it becomes necessary to solve the radiative transfer equation for polarized lines in moving atmospheres. Solutions based on the “observer’s frame method” are computationally expensive to obtain, especially when partial frequency redistribution (PRD) in line scattering and large-amplitude velocity fields are taken into account. In this paper we present an efficient alternative method of solution, namely, the comoving frame technique, to solve the polarized PRD line formation problems in the presence of velocity fields. We consider one-dimensional planar isothermal atmospheres with vertical velocity fields. We present a study of the effect of velocity fields on the emergent linear polarization profiles formed in optically thick moving atmospheres. We show that the comoving frame method is far superior when compared to the observer’s frame method in terms of the computational speed and memory requirements.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2013

PRESSURE OF THE PROTON PLASMA IN THE INNER HELIOSHEATH

We develop a physical model to study the pressure of the source proton plasma in the inner heliosheath based on the IBEX Energetic Neutral Atom (ENA) spectra. A multiple linear regression technique is used to parameterize the proton distribution function, by connecting the observed ENA flux spectrum from IBEX-Hi with the power-law of the model proton distribution. We calculate the partial pressure over the measured energy range, using (1) a non-parametric method by integrating the observed ENA flux, and (2) a parametric method by integrating the modeled distribution of protons in the inner heliosheath. The two sky maps of the parametric and non-parametric partial pressures are nearly identical, owing to their power-law distributions at high energies; the kappa distribution is such a function that can be reduced to a power-law in the IBEX-Hi energy range. The slight differences between the two partial pressures may indicate protons that are not described by the kappa distribution, and instead, involve newer or 'immature' (spherical shell) pick-up proton distributions. Ultimately, however, these become incorporated with the solar wind into one single proton population described by a kappa distribution. Moreover, we derive analytically (1) the ENA flux spectra, which suggests that this flux maximizes at {approx}30 eV, and (2) the differential pressure, which provides estimates of the partial pressures outside of those measured by IBEX-Hi. Under the assumptions of the modeled ENA spectra, the Ribbon emissions appear to be primarily limited to the energy ranges of IBEX-Lo and IBEX-Hi.

79 ASTRONOMY AND ASTROPHYSICS↗
NASA NTRS1991

Si II emission line diagnostics

The present study compares ratios of Si II UV emission lines in a variety of objects with computations based on recently published collisional data of Dufton and Kingston (1991). A high-quality spectrum of Alpha Tau (K5 III) obtained by Carpenter et al. (1991) is analyzed using the G270M mode of the GHRS on the HST, in addition to high-dispersion data from Skylab and IUE. Agreement between observation and theory is satisfactory for most lines. A blend with a line of Ni II accounts partially for the discrepancies and solves a problem with semiforbidden S II emission measures. Disagreement exists between certain observed flux ratios and computed values using recent atomic data for the intersystem lines. The discrepancy is most significant for Alpha Tau. The computed atomic collision strengths within the intersystem multiplet itself are argued as a possible cause of the discrepancy.

Judge, P. G.↗
DOE OSTI2017

Growth of electronically distinct manganite thin films by modulating cation stoichiometry

Nd 1-x Sr x MnO 3 (NSMO) is a well-known manganite due to close connection between structure, transport, magnetism, and chemistry. Thus, it would be an ideal system to study modification of physical properties by external stimuli including control of stoichiometry in growth. In this work, we show that abrupt change of electronic and magnetic properties can be achieved by subtle change of oxygen partial pressure in pulsed laser deposition. Interestingly, the pressure indeed modulates cation stoichiometry. We clearly observed that the films grown at 150 mTorr and higher showed clear insulator to metal transition and stronger magnetism, commonly found in less hole doping, while the films grown at 130 mTorr and lower showed insulating behavior and weak magnetism. From soft x-ray spectroscopic methods, we clearly observed the compositional difference in those thin films. This result is further supported by scattering of lighter elements in high oxygen partial pressure but not by anion deficiency in growth.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
NASA NTRS1989

Thermocapillary convection in zone-melting crystal growth - An open-boat physical simulation

Thermocapillary convection in a molten zone of NaNO3 contained in a boat with a free horizontal surface, that is heated from above by a centered wire heater, was studied to simulate flow in zone-melting crystal growth. Using a laser-light-cut technique and fine SiO powder as a tracer, convection in the melt zone was visualized in two different cases. In the first case, the entire melt surface was free, while in the second the melt surface was free only in the immediate vicinity of one vertical wall and was covered elsewhere, this wall being to simulate the melt/crystal interface during crystal growth. It was observed that thermocapillary convection near this wall prevailed in the first case, but was reduced significantly in the second. Since thermocapillary rather than natural convection dominated in the melt, the effect of the partial covering of the melt surface on thermocapillary convection in the melt observed in this study is expected to be similar under microgravity.

Kim, Y. J.↗
NASA NTRS1991

Inferring chromospheric flare heating from hydrogen-line wings

Strong flare heating that penetrates deeply into the solar chromosphere is examined, and a simple model that is supported by a numerical radiative transfer simulation is applied to study how elevated free electron densities produce markedly increased Stark emission in the wings of hydrogen Lyman and Balmer lines. The proportionality that exists between the observed Stark wing intensity and the total energy deposition in the partially ionized layer is calculated for various Lyman and Balmer lines. It is concluded that when the effects of background opacity sources on the wing enhancements are not important, the magnitude of the nonthermal heating that penetrates the chromosphere may be inferred from the observed line wings. It is predicted that Ly-alpha extended wings will exhibit enhancement of Stark shape, even when inherent damping wing opacity exceeds Stark wing opacity over the entire absorption profile.

Gayley, K. G.↗
DOE OSTI2019

How Tropical Pacific Surface Cooling Contributed to Accelerated Sea Ice Melt from 2007 to 2012 as Ice is Thinned by Anthropogenic Forcing

Over the past 40 years the Arctic sea ice minimum in September has declined. The period between 2007 and 2012 showed accelerated melt contributed to the record minima of 2007 and 2012. Here, observational and model evidence shows that the changes in summer sea ice since the 2000s reflects a continuous anthropogenically forced melting masked by interdecadal variability of Arctic atmospheric circulation. This variation is partially driven by teleconnections originating from sea surface temperature (SST) changes in the east-central tropical Pacific via a Rossby wave train propagating into the Arctic (hereafter referred to as the “Pacific-Arctic teleconnection (PARC)”), which represents the leading internal mode connecting the pole to lower latitudes. This mode has contributed to accelerated warming and Arctic sea ice loss from 2007 to 2012, followed by slower declines in recent years, resulting in the appearance of a slowdown over the past 11 years. A pacemaker model simulation, in which we specify observed SST in the tropical eastern Pacific, demonstrates a physically plausible mechanism for the PARC mode. However, the model-based PARC mechanism is considerably weaker and only partially accounts for the observed acceleration of sea ice loss from 2007 to 2012. Further research is needed to identify the reasons for model limitations in reproducing the PARC mode.

Baxter, Ian↗
DOE OSTI2021

CO2 partial pressure and fluxes in the Amazon River Plume using in situ and remote sensing data

Estimations of the global carbon budget include a quantitative understanding of the evolving processes that occur along river-to-ocean gradients. However, high spatiotemporal resolution observations of these processes are limited. Here we present in situ measurements of the partial pressure of CO2 (pCO2) made through the Amazon River plume (ARP) during different discharge seasons, from 2010-2012. We evaluated the spatiotemporal distribution of pCO2 using Soil Moisture and Ocean Salinity (SMOS) satellite observations for each hydrologic period in the ARP. Regression models were used to estimate pCO2 at the ARP for the period of 2010-2014. From these distributions we calculated sea-air gas exchange of CO2 between the plume waters and the atmosphere (F_co2^sea). Intra-annual variability of F_co2^sea was related to discharge at the river mouth and ocean currents as well as trade winds in the plume. Climatic events during the study period had a significant impact on the F_co2^sea. Including the plume area closer to the river mouth makes the ARP a net source of CO2 with an annual net sea-air flux of 8.6 ±7.1 Tg C y-1 from 2011-2014.

Amazon↗
DOE OSTI2021

Partial deconfinement at strong coupling on the lattice

We provide evidence for partial deconfinement — the deconfinement of a SU(M) subgroup of the SU(N) gauge group — by using lattice Monte Carlo simulations. We take matrix models as concrete examples. By appropriately fixing the gauge, we observe that the M × M submatrices deconfine. This gives direct evidence for partial deconfinement at strong coupling. We discuss the applications to QCD and holography.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗