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At least 1,621 records · Page 90
All sourcesNASA NTRSDOE OSTI
NASA NTRS1993

Nondestructive characterization of the elastic constants of fiber reinforced composites

Composite structural components may be subjected to a variety of defects resulting in a sharp reduction in their load carrying capacity or even catastrophic failure. Thus, it is extremely important to have the means to monitor the degradation suffered by critical components of a structure for safe operation during its service life. A nondestructive method based on ultrasonics has recently been developed for the quantitative evaluation of composite structural components during service. The experimental part of the technique uses a two-transducer, pitch-catch type arrangement to generate a variety of elastic waves within the specimen immersed in water. The recorded reflection data are then analyzed by means of a theoretical model to back out the relevant properties. In this paper the method is applied to determine the stiffness constants of unidirectional graphite/epoxy materials. The measurements are shown to be efficient and sufficiently accurate so that it can be used for early detection of material degradation in composite structural elements during service.

Mal, Ajit K.↗
NASA NTRS1998

Biomarkers as tracers for life on early earth and Mars

Biomarkers in geological samples are products derived from biochemical (natural product) precursors by reductive and oxidative processes (e.g., cholestanes from cholesterol). Generally, lipids, pigments and biomembranes are preserved best over longer geological times and labile compounds such as amino acids, sugars, etc. are useful biomarkers for recent times. Thus, the detailed characterization of biomarker compositions permits the assessment of the major contributing species of extinct and/or extant life. In the case of the early Earth, work has progressed to elucidate molecular structure and carbon isotropic signals preserved in ancient sedimentary rocks. In addition, the combination of bacterial biochemistry with the organic geochemistry of contemporary and ancient hydrothermal ecosystems permits the modeling of the nature, behavior and preservation potential of primitive microbial communities. This approach uses combined molecular and isotopic analyses to characterize lipids produced by cultured bacteria (representative of ancient strains) and to test a variety of culture conditions which affect their biosynthesis. On considering Mars, the biomarkers from lipids and biopolymers would be expected to be preserved best if life flourished there during its early history (3.5-4 x 10(9) yr ago). Both oxidized and reduced products would be expected. This is based on the inferred occurrence of hydrothermal activity during that time with the concomitant preservation of biochemically-derived organic matter. Both known biomarkers (i.e., as elucidated for early terrestrial samples and for primitive terrestrial microbiota) and novel, potentially unknown compounds should be characterized.

Non-NASA Center↗
DOE OSTI2017

Analysis of heating load diversity in German residential districts and implications for the application in district heating systems

In recent years, the application of district heating systems for the heat supply of residential districts has been increasing in Germany. Central supply systems can be very efficient due to diverse energy demand profiles which may lead to reduced installed equipment capacity. Load diversity in buildings has been investigated in former studies, especially for the electricity demand. However, little is known about the influence of single building characteristics (such as building envelope or hot water demand) on the overall heating peak load of a residential district. For measuring the diversity, the peak load ratio (PLR) index is used to represent the percentage reduction of peak load of a district system from a simple sum of individual peak loads of buildings. A total of 144 residential building load profiles have been created with the dynamic building simulation software IDA ICE for a theoretical analysis in which the PLR reaches 15%. Within this study, certain district features are identified which lead to higher diversity. Furthermore, these results are used in a district heating simulation model which confronts the possible advantage of reduced installed capacity with the practical disadvantage of heat distribution losses. Likewise, the influence of load density and the districts building structure can be analyzed. This study shows that especially in districts with high load density, which consist of newly constructed buildings with low supply temperature and high influence of the hot water demand, the advantages of load diversity can be exploited.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗
DOE OSTI2023

Domain crossover in the reductase subunit of NADPH-dependent assimilatory sulfite reductase

NADPH-dependent assimilatory sulfite reductase (SiR) from Escherichia coli performs a six-electron reduction of sulfite to the bioavailable sulfide. SiR is composed of a flavoprotein (SiRFP) reductase subunit and a hemoprotein (SiRHP) oxidase subunit. There is no known high-resolution structure of SiR or SiRFP, thus we do not yet fully understand how the subunits interact to perform their chemistry. Here, we used small-angle neutron scattering to understand the impact of conformationally restricting the highly mobile SiRFP octamer into an electron accepting (closed) or electron donating (open) conformation, showing that SiR remains active, flexible, and asymmetric even with these conformational restrictions. From these scattering data, we then model the first solution structure of SiRFP. Further, computational modeling of the N-terminal 52 amino acids that are responsible for SiRFP oligomerization suggests an eight-helical bundle tethers together the SiRFP subunits to form the SiR core. Finally, mass spectrometry analysis of the closed SiRFP variant show that SiRFP is capable of inter-molecular domain crossover, in which the electron donating domain from one polypeptide is able to interact directly with the electron accepting domain of another polypeptide. This structural characterization suggests that SiR performs its high-volume electron transfer through both inter- and intramolecular pathways between SiRFP domains and, thus, cis or trans transfer from reductase to oxidase subunits. Such highly redundant potential for electron transfer makes this system a potential target for designing synthetic enzymes.

59 BASIC BIOLOGICAL SCIENCES↗
DOE OSTI2017

Influence of skin surface roughness degree on energy characteristics of light scattered by a biological tissue

We present the results of modelling of photometric characteristics of light in soft tissues illuminated by a parallel beam along the normal to the surface, obtained with allowance for the skin roughness parameters and the angular structure of radiation approaching the surface from within the tissue. The depth structure of the fluence rate and the spectra of the diffuse reflection of light by the tissue in the interval of wavelengths 300 – 1000 nm are considered. We discuss the influence of the tilt angle variance of rough surface microelements and light refraction on the studied characteristics. It is shown that these factors lead to the reduction of the radiation flux only in the near-surface tissue layer and practically do not affect the depth of light penetration into the tissue. On the other hand, the degree of the surface roughness and the conditions of its illumination from within the tissue essentially affect the coefficient of diffuse reflection of light and lead to its considerable growth compared to the cases of a smooth interface and completely diffuse illumination, often considered to simplify the theoretical problem solution. The role of the roughness of skin surface is assessed in application to the solution of different direct and inverse problems of biomedical optics. (paper)

60 APPLIED LIFE SCIENCES↗
DOE OSTI2019

α decay of high-spin isomers in N = 84 isotones

The superfluid tunneling model is applied to the calculation of half-lives of the observed α decays in N = 84 isotones. Here the results of our calculations are compared to experimental data on the ground-state α decays along the isotonic chain from 144 Nd to 159 Re. Good agreement is found. The α decays of the known high-spin isomers in 155 Lu, 156 Hf, 157 Ta, and 158 W are also well reproduced, once a reduction in the pairing strength is taken into account. This includes reproduction of the main features of the recently observed fine structure from 155 Lu(25/2 - ) and 156 Hf(8 + ). Predictions for the α-decay fine structure of 157 Ta(25/2 - ) and 158 W(8 + ) high-spin isomers are presented.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2021

Spin Berry points as crucial for ultrafast demagnetization

Laser-induced ultrafast demagnetization has puzzled researchers around the world for over two decades. Intrinsic complexity in electronic, magnetic and phononic subsystems is difficult to understand microscopically. So far, it is not possible to explain demagnetization using a single mechanism, which suggests a crucial piece of information still missing. In this paper, we return to a fundamental aspect of physics: spin and its change within each band in the entire Brillouin zone. We employ face-centered cubic (fcc) Ni as an example and use an extremely dense k mesh to map out spin changes for every band close to the Fermi level along all the high symmetry lines. To our surprise, spin angular momentum at some special k points abruptly changes from [Formula: see text] to [Formula: see text] simply by moving from one crystal momentum point to the next. This explains why intraband transitions, which the spin superdiffusion model is based upon, can induce a sharp spin moment reduction, and why electric current can change spin orientation in spintronics. These special k points, which are called spin Berry points [M. V. Berry, Proc. R. Soc. Lond. A 393 (1984) 45], are not random and appear when several bands are close to each other, so the Berry potential of spin majority states is different from that of spin minority states. Although within a single band, spin Berry points jump, when we group several neighboring bands together, they form distinctive smooth spin Berry lines. It is the band structure that disrupts those lines. Spin Berry points are crucial to laser-induced ultrafast demagnetization and spintronics.

Physics↗
DOE OSTI2020

Editors’ Choice—Review—Recent Advances in Mixed Potential Sensors

Gas sensors are widely used in environmental monitoring and provide controls especially when working with toxic gases. YSZ based λ-sensors have been utilized in the automobile industry for exhaust gas monitoring for more than 40 years. However, recent regulations on emissions reduction has forced further development of toxic gases monitoring in various applications. Mixed potential sensors with YSZ electrolyte are receiving increased attention due to their higher sensitivity and durability under harsh conditions. This review focuses on recent (past 5 years) developments made on electrode and electrolyte structure along with new sensing electrode materials towards detecting gases such as NO x , NH 3 , H 2 , CO and hydrocarbons (HCs). The theory of mixed potential sensors is discussed along with recent developments in detection of multi-gas mixtures using the output from an array of sensors in a mathematical model. Future directions for mixed potential sensor research, and methodologies to improving sensing characteristics are also outlined

47 OTHER INSTRUMENTATION↗
DOE OSTI2015

Loss of the Arabidopsis thaliana P4-ATPases ALA6 and ALA7 impairs pollen fitness and alters the pollen tube plasma membrane

Members of the P4 subfamily of P-type ATPases are thought to create and maintain lipid asymmetry in biological membranes by flipping specific lipids between membrane leaflets. In Arabidopsis, 7 of the 12 Aminophospholipid ATPase (ALA) family members are expressed in pollen. Here we show that double knockout of ALA6 and ALA7 (ala6/7) results in siliques with a ~2-fold reduction in seed set with a high frequency of empty seed positions near the bottom. Seed set was reduced to near zero when plants were grown under a hot/cold temperature stress. Reciprocal crosses indicate that the ala6/7 reproductive deficiencies are due to a defect related to pollen transmission. In-vitro growth assays provide evidence that ala6/7 pollen tubes are short and slow, with ~2-fold reductions in both maximal growth rate and overall length relative to wild-type. Outcrosses show that when ala6/7 pollen are in competition with wild-type pollen, they have a near 0% success rate in fertilizing ovules near the bottom of the pistil, consistent with ala6/7 pollen having short and slow growth defects. The ala6/7 phenotypes were rescued by the expression of either an ALA6-YFP or GFP-ALA6 fusion protein, which showed localization to both the plasma membrane and highly-mobile endomembrane structures. A mass spectrometry analysis of mature pollen grains revealed significant differences between ala6/7 and wild-type, both in the relative abundance of lipid classes and in the average number of double bonds present in acyl side chains. A change in the properties of the ala6/7 plasma membrane was also indicated by a ~10-fold reduction of labeling by lipophilic FM-dyes relative to wild-type. Together, these results indicate that ALA6 and ALA7 provide redundant activities that function to directly or indirectly change the distribution and abundance of lipids in pollen, and support a model in which ALA6 and ALA7 are critical for pollen fitness under normal and temperature-stress conditions.

59 BASIC BIOLOGICAL SCIENCES↗
NASA NTRS1980

Projected noise in submillimeter-wave mixers with InSb Schottky diodes

The reduction of the equivalent noise temperature in liquid-nitrogen-cooled submillimeter-wave mixers by the use of Schottky barriers on InSb instead of GaAs is evaluated by an analytical model that assumes limited local oscillator power and matched impedances. The calculations, executed at 1.0 and 1.8 THz, take plasma resonance and skin effect into account. For single and multiple contacts on homogeneous semiconductor materials of optimum doping, the noise of InSb diodes is smaller than that of GaAs diodes by a factor of 3 to 14. A simplified model is used to predict the performance of epitaxial structures as well as alternative materials.

Lieneweg, U.↗
NASA NTRS1992

The ultraviolet albedo of Mars

Ultraviolet observations have proven successful at studying the composition and structure of the upper atmospheres of the giant planets and Venus. In the case of Mars, the analysis of UV data has concentrated on the spatial distribution and temporal behavior of ozone. The potential of far ultraviolet (FUV) data (shortward of 200 nm) for measuring the atmospheric structure, in particular the vertical distribution of aerosols, is demonstrated. For illustrative purposes, a simple two layer model (atmosphere and surface) is computed using the atmospheric composition measured at the Viking landing sites. This model is then compared to the albedo observed with the International Ultraviolet Explorer (IUE). This comparison clearly shows that a clear atmosphere with the nominal Viking mixing ratios of CO2, O2, and H2O is incompatible with the IUE data shortward of 200 nm. To obtain a better match between data and model, an aerosol has to be introduced that effectively scatters at these wavelengths. The required reduction in effective CO2 pathlength is a factor of 5. The comparison also points out the inadequacy of the IUE to provide data in the critical wavelength region between 195 nm and 210 nm. Such data will be forthcoming from the Hubble Space Telescope and will provide the opportunity to infer the vertical distribution of aerosols on Mars on a global scale.

Wagener, R.↗
NASA NTRS1992

Control-structure interaction/mirror motion compensation

Space Systems/Loral (formerly Ford Aerospace, Space Systems Division) has implemented a rigid-body Mirror Motion Compensation (MMC) scheme for the GOES-I/M spacecraft currently being built for NASA and NOAA. This has resulted in a factor of 15 reduction in pointing error due to rigid-body spacecraft motion induced by the periodic black-body calibration maneuvers required for the instruments. For GOES the spacecraft and the payload mirrors are considered as rigid bodies. The structural flexibility effects are small and are included in the total pointing budget as a separate item. This paper extends the MMC technique to include structural flexibility. For large multi-payload platforms, the structural flexibility effects can be more important in sensor pointing jitter as the result of payload motion. Sensitivity results are included to show the importance of the dynamic model fidelity.

Mclaren, Mark↗
DOE OSTI2014

Activation Neutronics for a Swiss PWR: Simulations and Validation - Paper 102

In Switzerland 40% of the electricity generation is produced by nuclear power. With all four NPPs being already beyond their 30. year of operation, Nagra in collaboration with the utilities periodically contributes to the Swiss NPP decommissioning cost estimation studies. The neutron induced activation of structures and components of the NPPs is of particular relevance for the planning of the dismantling actions, the waste-packaging concept, the waste-management considerations and, therefore, the estimation of decommissioning costs. In this context, Nagra has developed a calculation sequence in order to perform state-of-the-art neutron transport and activation calculations. In this paper, aspects relevant to the neutron transport calculations for estimating the residual radioactivity within a Swiss PWR are presented. More specifically, the MCNP5 modeling approach together with the use of the ADVANTG-hybrid code for accelerating the variance reduction efforts is outlined. Additionally, the validation of the neutron transport calculations with in-situ full-cycle foil activation campaigns is discussed. (authors)

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗
DOE OSTI2023

Atomistic insight into the effects of electrostatic fields on hydrocarbon reaction kinetics

Reactive Molecular Dynamics (MD) and Density Functional Theory (DFT) computations are performed to provide insight into the effects of external electrostatic fields on hydrocarbon reaction kinetics. By comparing the results from MD and DFT, the suitability of the MD method in modeling electrodynamics is first assessed. Results show that the electric field-induced polarization predicted by the MD charge equilibration method is in good agreement with various DFT charge partitioning schemes. Then, the effects of oriented external electric fields on the transition pathways of non-redox reactions are investigated. Results on the minimum energy path suggest that electric fields can cause catalysis or inhibition of oxidation reactions, whereas pyrolysis reactions are not affected due to the weaker electronegativity of the hydrogen and carbon atoms. MD simulations of isolated reactions show that the reaction kinetics is also affected by applied external Lorentz forces and interatomic Coulomb forces since they can increase or decrease the energy of collision depending on the molecular conformation. In addition, electric fields can affect the kinetics of polar species and force them to align in the direction of field lines. These effects are attributed to energy transfer via intermolecular collisions and stabilization under the external Lorentz force. The kinetics of apolar species is not significantly affected mainly due to the weak induced dipole moment even under strong electric fields. The dynamics and reaction rates of species are studied by means of large-scale combustion simulations of n-dodecane and oxygen mixtures. Results show that under strong electric fields, the fuel, oxidizer, and most product molecules experience translational and rotational acceleration mainly due to close charge transfer along with a reduction in their vibrational energy due to stabilization. This study will serve as a basis to improve the current methods used in MD and to develop novel methodologies for the modeling of macroscale reacting flows under external electrostatic fields.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2013

HYBRID COSMOLOGICAL SIMULATIONS WITH STREAM VELOCITIES

In the early universe, substantial relative ''stream'' velocities between the gas and dark matter arise due to radiation pressure and persist after recombination. To assess the impact of these velocities on high-redshift structure formation, we carry out a suite of high-resolution adaptive mesh refinement (AMR) cosmological simulations, which use smoothed particle hydrodynamic data sets as initial conditions, converted using a new tool developed for this work. These simulations resolve structures with masses as small as a few 100 M{sub Sun }, and we focus on the 10{sup 6} M{sub Sun} ''mini-halos'' in which the first stars formed. At z Almost-Equal-To 17, the presence of stream velocities has only a minor effect on the number density of halos below 10{sup 6} M{sub Sun }, but it greatly suppresses gas accretion onto all halos and the dark matter structures around them. Stream velocities lead to significantly lower halo gas fractions, especially for Almost-Equal-To 10{sup 5} M{sub Sun} objects, an effect that is likely to depend on the orientation of a halo's accretion lanes. This reduction in gas density leads to colder, more compact radial profiles, and it substantially delays the redshift of collapse of the largest halos, leading to delayed star formation and possibly delayed reionization. These many differences suggest that future simulations of early cosmological structure formation should include stream velocities to properly predict gas evolution, star formation, and the epoch of reionization.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2020

Galaxy clustering in the DESI Legacy Survey and its imprint on the CMB

ABSTRACT We use data from the DESI Legacy Survey imaging to probe the galaxy density field in tomographic slices covering the redshift range 0 < z < 0.8. After careful consideration of completeness corrections and galactic cuts, we obtain a sample of 4.9 × 107 galaxies covering 17 739 deg2. We derive photometric redshifts with precision σz/(1 + z) = 0.012−0.015, and compare with alternative estimates.1 Cross-correlation of the tomographic galaxy maps with Planck maps of cosmic microwave background (CMB) temperature and lensing convergence probe the growth of structure since z = 0.8. The signals are compared with a fiducial Planck ΛCDM model, and require an overall scaling in amplitude of Aκ = 0.901 ± 0.026 for the lensing cross-correlation and AISW = 0.984 ± 0.349 for the temperature cross-correlation, interpreted as the integrated Sachs–Wolfe effect. The ISW amplitude is consistent with the fiducial Λ cold dark matter (ΛCDM) prediction, but lies significantly below the prediction of the AvERA model of Rácz et al., which has been proposed as an alternative explanation for cosmic acceleration. Within ΛCDM, our low amplitude for the lensing cross-correlation requires a reduction either in fluctuation normalization or in matter density compared to the Planck results, so that $\Omega _\mathrm{ m}^{0.78}\sigma _8=0.297\pm 0.009$. In combination with the total amplitude of CMB lensing, this favours a shift mainly in density: Ωm = 0.274 ± 0.024. We discuss the consistency of this figure with alternative evidence. A conservative compromise between lensing and primary CMB constraints would require Ωm = 0.296 ± 0.006, where the 95 per cent confidence regions of both probes overlap.

Hang, Qianjun↗
NASA NTRS2018

Simulation of Stochastic Mud-Crack Damage Formation in an Environmental Barrier Coating

The integrated Finite Element Analysis–Micromechanics Analysis Code/Ceramics Analysis and Reliability Evaluation of Structures (FEAMAC/CARES) program was used to simulate the formation of mudflat-cracks from thermomechanical loading on a multi-layered Environmental Barrier Coating (EBC) system deposited on a ceramic substrate. FEAMAC/CARES combines MAC/GMC multiscale composite micromechanics code with CARES/Life probabilistic multiaxial failure criteria code and Abaqusfinite element analysis. In this work, step function elastic modulus reduction of randomly damaged finite elements was used to represent discrete cracking events. The use of many small-sized low-aspect-ratio finite elements enabled the depiction of crack boundaries and formation of mudflat patterned damage. Demonstrated examples include finite element models of button–sized disk–shaped 3-D specimen, and a 2-D model of through-the-thickness cross-section. All models were subjected to a progressive cool down from 1300oC to room temperature. Mudflat crack damage in the coating system resulted from the buildup of residual tensile stresses between the individual material constituents from thermal expansion mismatch. A 2-parameter Weibull distribution characterized the coating layer stochastic strength response and the effect of the Weibull modulus on the formation of damage was studied here.

residual tensile stress↗
DOE OSTI2019

Photocatalytic Facet Selectivity in BiVO 4 Nanoparticles: Polaron Electronic Structure and Thermodynamic Stability Considerations for Photocatalysis

Selective charge separation among different crystal facets of a semiconductor is an intriguing phenomenon for which there is no firm and full theoretical foundation currently. In this work, we report on a density functional theory + U characterization of band alignment and electron and hole polaron stabilities among the (010), (110), and (011) facets of bismuth vanadate BiVO 4 (BVO). Computation-derived band alignment indicates that the conduction band minima are at nearly the same level among the three facets but that the valence band maxima exhibit a shift. We also modeled electron and hole polarons as localized electrons and holes on vanadium and oxygen, respectively, and determined their relative stabilities from a “bulk” region to a surface region. Calculated stabilities reveal similar stability profiles across the various facets, with electron polarons most stable when localized on subsurface V atoms and hole polarons most stable on surface O atoms. Calculations indicate a small stability preference for electron polarons toward the (011) facet and for hole polarons toward the (110) facet, whereas, experimentally, interfacial reduction is observed to take place selectively on the (010) facet and oxidation on the (110) and (011) facets. Facet selectivity could be occurring on the basis of thermodynamics (electron or holes showing a stronger affinity for some facets over others) or kinetics (electron or hole transport and/or redox processes being more efficient toward/on some facets over others) or a combination of both. This work establishes that thermodynamic stability alone is not responsible for the observed facet selectivity in BVO. Furthermore, we surmise that polaron transport kinetics and interfacial redox kinetics are likely to have a role in facet selectivity in BVO. These issues will be the subject of future publications.

14 SOLAR ENERGY↗