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At least 361 records · Page 20

Fracture resistance of hierarchical Cu–Mo nanocomposite thin films

We report the fracture behavior of high-temperature co-sputtered Cu/Mo nanocomposite thin films was investigated through in situ 3-point bend testing of pre-notched microbeams in SEM. The as-synthesized nanocomposites present hierarchical nano/microstructures composed of a matrix of phase-separated Cu–Mo with nanoscale ligaments dispersed with sub-micron scale Cu-rich islands containing Mo nano-precipitates. Results show a significant crack growth resistance in the hierarchical nanocomposite, several times higher than that measured in Cu/Mo nanoscale multilayers. Based on electron microscopy characterization, three mechanisms of crack growth resistance in the hierarchical structures are proposed: crack bridging by the Cu-rich layer, crack deflection via shear along the Cu/Mo interface, and multiple cracking. This work demonstrates an approach to increase toughness in high strength nanocomposites through interface micro-structure design.

36 MATERIALS SCIENCE↗

Atomistic Origin of Microsecond Carrier Lifetimes at Perovskite Grain Boundaries: Machine Learning-Assisted Nonadiabatic Molecular Dynamics

The polycrystalline nature of perovskites, stemming from their facile solution-based fabrication, leads to a high density of grain boundaries (GBs) and point defects. However, the impact of GBs on perovskite performance remains uncertain, with contradictory statements found in the literature. We developed a machine learning force field, sampled GB structures on a nanosecond time scale, and performed nonadiabatic (NA) molecular dynamics simulations of charge carrier trapping and recombination in stoichiometric and doped GBs. The simulations reveal long, microsecond carrier lifetimes, approaching experimental data, stemming from charge separation at the GBs and small NA coupling, 0.01–0.1 meV. Stoichiometric GBs exhibit transient trap states, which, however, are not particularly detrimental to the carrier lifetime. Halide dopants form interstitial defects in the bulk, but have a stabilizing influence on the GB structure by passivating undersaturated Pb atoms and reducing the transient trap state formation. On the contrary, excess Pb destabilizes GBs, allowing formation of persistent midgap states that trap charges. Still, the charge carrier lifetime reduces relatively little, because the midgap states decouple from the bands, and charges are more likely to escape back into bands upon a GB structural fluctuation. The atomistic study into the structural dynamics of perovskite GBs and its influence on charge carrier trapping and recombination provides valuable insights into the complex properties of perovskites and the intricate role of GBs in the material performance.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Flare build-up study - Homologous flares group. I

Solar Maximum Mission observations have been used to study the origin and amount of energy, mechanism of storage and release, and conditions for the occurrence of solar flares, and some results of these studies as they pertain to homologous flares are briefly discussed. It was found that every set of flares produced 'rafales' of homologous flares, i.e., two, three, four, or more flares separated in time by an hour or less. No great changes in macroscopic photospheric patterns were observed during these flaring periods. A quantitative brightness parameter of the relation between homologous flares is defined. Scale changes detected in the dynamic spectrum of flare sites are in good agreement with a theoretical suggestion by Sturrock. Statistical results for different homologous flare active regions show the existence in homologous flaring areas of a 'pivot' of previous filaments interpreted as a signature of an anomaly in the solar rotation.

Martres, M.-J.↗

An experimental low Reynolds number comparison of a Wortmann FX67-K170 airfoil, a NACA 0012 airfoil and a NACA 64-210 airfoil in simulated heavy rain

Wind tunnel experiments were conducted on Wortmann FX67-K170, NACA 0012, and NACA 64-210 airfoils at rain rates of 1000 mm/hr and Reynolds numbers of 310,000 to compare the aerodynamic performance degradation of the airfoils and to attempt to identify the various mechanisms which affect performance in heavy rain conditions. Lift and drag were measured in dry and wet conditions, a variety of flow visualization techniques were employed, and a computational code which predicted airfoil boundary layer behavior was used. At low angles of attack, the lift degradation in wet conditions varied significantly between the airfoils. The Wortmann section had the greatest overall lift degradation and the NACA 64-210 airfoil had the smallest. At high angles of attack, the NACA 64-210 and 0012 airfoils had improved aerodynamic performance in rain conditions due to an apparent reduction of the boundry layer separation. Performance degradation in heavy rain for all three airfoils at low angles of attack could be emulated by forced boundary layer transition near the leading edge. The secondary effect occurs at time scales consistent with top surface water runback times. The runback layer is thought to effectively alter the airfoil geometry. The severity of the performance degradation for the airfoils varied. The relative differences appeared to be related to the susceptibility of each airfoil to premature boundary layer transition.

Craig, Anthony P.↗

Coarsening following a morphological instability in the one-sided model

We study the coarsening of the interfacial pattern separating two coexisting phases after the pattern becomes morphologically unstable. Shortly after the instability, the scale of the structure is given by the most unstable wave number in the linear regime. At later times, nonlinear interactions cause the structure to coarsen. Coarsening is studied by monitoring the time dependence of the two-dimensional power spectrum of the pattern, especially for wave vectors transverse to the direction of growth. Characteristic length scales of the pattern obtained from moments of the power spectrum are asymptotically linear in time. Furthermore, the power spectrum is seen to satisfy a scaling relation, in agreement with previous studies. A normal-velocity autocorrelation function is calculated and found to decay substantially over length scales that are of the order of the scale of the pattern. The issue of spatial anisotropy in the correlation functions is also discussed.

Vinals, Jorge↗

Global Analysis of Empirical Relationships Between Annual Climate and Seasonality of NDVI

This paper describes the use of satellite data to calibrate a new climate-vegetation greenness relationship for global change studies. We examined statistical relationships between annual climate indexes (temperature, precipitation, and surface radiation) and seasonal attributes If the AVHRR Normalized Difference Vegetation Index (NDVI) time series for the mid-1980's in order to refine our understanding of intra-annual patterns and global abiotic controls on natural vegetation dynamics. Multiple linear regression results using global 1o gridded data sets suggest that three climate indexes: degree days (growing/chilling), annual precipitation total, and an annual moisture index together can account to 70-80 percent of the geographic variation in the NDVI seasonal extremes (maximum and minimum values) for the calibration year 1984. Inclusion of the same annual climate index values from the previous year explains no substantial additional portion of the global scale variation in NDVI seasonal extremes. The monthly timing of NDVI extremes is closely associated with seasonal patterns in maximum and minimum temperature and rainfall, with lag times of 1 to 2 months. We separated well-drained areas from lo grid cells mapped as greater than 25 percent inundated coverage for estimation of both the magnitude and timing of seasonal NDVI maximum values. Predicted monthly NDVI, derived from our climate-based regression equations and Fourier smoothing algorithms, shows good agreement with observed NDVI for several different years at a series of ecosystem test locations from around the globe. Regions in which NDVI seasonal extremes are not accurately predicted are mainly high latitude zones, mixed and disturbed vegetation types, and other remote locations where climate station data are sparse.

Potter, C. S.↗

Global Analysis of Empirical Relationships Between Annual Climate and Seasonality of NDVI

This study describes the use of satellite data to calibrate a new climate-vegetation greenness function for global change studies. We examined statistical relationships between annual climate indexes (temperature, precipitation, and surface radiation) and seasonal attributes of the AVHRR Normalized Difference Vegetation Index (NDVI) time series for the mid-1980s in order to refine our empirical understanding of intraannual patterns and global abiotic controls on natural vegetation dynamics. Multiple linear regression results using global l(sup o) gridded data sets suggest that three climate indexes: growing degree days, annual precipitation total, and an annual moisture index together can account to 70-80 percent of the variation in the NDVI seasonal extremes (maximum and minimum values) for the calibration year 1984. Inclusion of the same climate index values from the previous year explained no significant additional portion of the global scale variation in NDVI seasonal extremes. The monthly timing of NDVI extremes was closely associated with seasonal patterns in maximum and minimum temperature and rainfall, with lag times of 1 to 2 months. We separated well-drained areas from l(sup o) grid cells mapped as greater than 25 percent inundated coverage for estimation of both the magnitude and timing of seasonal NDVI maximum values. Predicted monthly NDVI, derived from our climate-based regression equations and Fourier smoothing algorithms, shows good agreement with observed NDVI at a series of ecosystem test locations from around the globe. Regions in which NDVI seasonal extremes were not accurately predicted are mainly high latitude ecosystems and other remote locations where climate station data are sparse.

Potter, C. S.↗

Recent Advances in Our Understanding of the Earth's Radiation Belts

The Earth's radiation belts were discovered by James van Allen more than fifty years ago and are a home to a plethora of fascinating processes ranging from low energy cold plasma to relativistic and ultra-relativistic particle populations. The traditional morphological picture of the radiation belts is that of an outer belt comprising mostly of electrons and an inner belt comprising mostly of protons with a so-called slot region separating the two. The inner belt is somewhat stable, while the outer radiation belt is very dynamical and shows variability in energetic electron populations over a wide range of energies, intensities, and time scales ranging from minutes, days and even years. This variability is due to dynamical processes of energization and loss with a variety of plasma waves playing an important and crucial role. The traditional picture has recently been challenged with new observations coming from the twin spacecraft mission, Van Allen Probes launched in the fall of 2012, which carries a comprehensive suite of instruments that measure particles and plasma waves. In more than 5 years of observations Van Allen Probes has advanced our understanding of fundamental questions regarding the acceleration and loss of outer Van Allen belt electron population. Van Allen Probes observations have also revealed new phenomena such as the "electron Storage ring", and the "impenetrable barrier". This article reviews electron dynamics in the Van Allen belts focusing on van Allen Probes observations and discuss exciting new ways of advancing radiation belt science with CubeSats and CubeSat constellations.

Relativistic electrons↗

Parallel physics-informed neural networks via domain decomposition

Here we develop a distributed framework for the physics-informed neural networks (PINNs) based on two recent extensions, namely conservative PINNs (cPINNs) and extended PINNs (XPINNs), which employ domain decomposition in space and in time-space, respectively. This domain decomposition endows cPINNs and XPINNs with several advantages over the vanilla PINNs, such as parallelization capacity, large representation capacity, efficient hyperparameter tuning, and is particularly effective for multi-scale and multi-physics problems. Here, we present a parallel algorithm for cPINNs and XPINNs constructed with a hybrid programming model described by MPI + X, where X ∈ {CPUs, GPUs}. The main advantage of cPINN and XPINN over the more classical data and model parallel approaches is the flexibility of optimizing all hyperparameters of each neural network separately in each subdomain. We compare the performance of distributed cPINNs and XPINNs for various forward problems, using both weak and strong scalings. Our results indicate that for space domain decomposition, cPINNs are more efficient in terms of communication cost but XPINNs provide greater flexibility as they can also handle time-domain decomposition for any differential equations, and can deal with any arbitrarily shaped complex subdomains. To this end, we also present an application of the parallel XPINN method for solving an inverse diffusion problem with variable conductivity on the United States map, using ten regions as subdomains.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Scaling electrospray based additive manufacturing of polyamide membranes

Additive manufacturing based on electrospray printing has been demonstrated to fabricate polyamide membranes with separation properties similar to commercial membranes while also offering exceptional control of membrane thickness and roughness. In this work, we report on the scalability of the electrospray process to produce membrane leaves that are 10 times the area of membranes fabricated in literature through electrospray printing. The large membrane leaves exhibited salt rejection of >90% (at 2000 ppm feed salt concentration) and ∼0.7 LMH/bar flux, which is comparable to smaller printed membranes using the same process.

Additive manufacturing↗

Dynamic System Scaling Application to Accelerated Nuclear Fuel Testing

The development of nuclear fuel and materials requires a continuous effort to investigate the acute and prolonged effects of irradiation, thermal-material stress, chemical change, or other conceivable damage mechanics acquired during normal operation or accident scenarios throughout its lifetime. As in-core fuel property measurement techniques advance to support in the real-time, non-invasive, and enhanced accuracy realm, it is the future of fuel development to pursue to higher degrees of control, predictability of integral test behavior via separate effects test (SET), and shorter test time intervals. The fuel development life cycle from initial concept to commercial licensing is approximated to be 20 years and current literature suggests by optimizing fuel performance codes with SETs, the process could possibly be compressed to 5 to 10 years. Recently, a research group in the Idaho National Laboratory (INL) is testing reduced scale fuel rods and increased power density to accelerate evolution of fuel phenomena in metallic fuels. In support of nuclear fuel rod development, compressing fuel test process, and accelerating fuel phenomena, it was the purpose of this study to investigate nuclear fuel performance phenomena via literature review and effectively scale the initial conditions, boundary conditions, and geometric properties to describe the time-dependent response including to fuel burnup, thermal and mechanical stress, transmutations and inter-diffusion, and other relevant observed phenomena. The study was based on BISON simulations of historic EBR-II metallic fuel experiments and Dynamical System Scaling (DSS) method are utilized to assess effects of scaling activity including fuel phenomena acceleration and calculations of time-dependent distortions. The research successfully scaled metallic fuel phenomena, accelerated fuel testing, and assessed the distortions for each scaled case derived.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Intercomparison of Three Continuous Monitoring Systems on Operating Oil and Gas Sites

We compare continuous monitoring systems (CMS) from three different vendors on six operating oil and gas sites in the Appalachian Basin using several months of data. We highlight similarities and differences between the three CMS solutions when deployed in the field and compare their output to concurrent top-down aerial measurements and to site-level bottom-up inventories. Furthermore, we compare vendor-provided emission rate estimates to estimates from an open-source quantification algorithm applied to the raw CMS concentration data. This experimental setup allows us to separate the effect of the sensor platform (i.e., sensor type and arrangement) from the quantification algorithm. We find that 1) localization and quantification estimates rarely agree between the three CMS solutions on short time scales (i.e., 30 min), but temporally aggregated emission rate distributions are similar between solutions, 2) differences in emission rate distributions are generally driven by the quantification algorithm, rather than the sensor platform, 3) agreement between CMS and aerial rate estimates varies by CMS solution but is close to parity when CMS estimates are averaged across solutions, and 4) similar sites with similar bottom-up inventories do not necessarily have similar emission characteristics. These results have important implications for developing measurement-informed inventories and for incorporating CMS-inferred emission characteristics into emission mitigation efforts.

54 ENVIRONMENTAL SCIENCES↗

The Complex, Unique, and Powerful Imaging Instrument for Dynamics (CUPI 2 D) at the Spallation Neutron Source (invited)

The Oak Ridge National Laboratory is planning to build the Second Target Station (STS) at the Spallation Neutron Source (SNS). STS will host a suite of novel instruments that complement the First Target Station’s beamline capabilities by offering an increased flux for cold neutrons and a broader wavelength bandwidth. A novel neutron imaging beamline, named the Complex, Unique, and Powerful Imaging Instrument for Dynamics (CUPI 2 D), is among the first eight instruments that will be commissioned at STS as part of the construction project. CUPI 2 D is designed for a broad range of neutron imaging scientific applications, such as energy storage and conversion (batteries and fuel cells), materials science and engineering (additive manufacturing, superalloys, and archaeometry), nuclear materials (novel cladding materials, nuclear fuel, and moderators), cementitious materials, biology/medical/dental applications (regenerative medicine and cancer), and life sciences (plant–soil interactions and nutrient dynamics). The innovation of this instrument lies in the utilization of a high flux of wavelength-separated cold neutrons to perform real time in situ neutron grating interferometry and Bragg edge imaging—with a wavelength resolution of δλ/λ ≈ 0.3%—simultaneously when required, across a broad range of length and time scales. This manuscript briefly describes the science enabled at CUPI 2 D based on its unique capabilities. The preliminary beamline performance, a design concept, and future development requirements are also presented.

47 OTHER INSTRUMENTATION↗

A first-principles derivation of Doppler noise expected from solar wind density fluctuations

The level of Doppler noise (DN) expected from solar wind (SW) density fluctuations (DF) is derived beginning with the expression for refractive index variations. The calculation takes account of up and downlink paths and of the method actually used to produce the DN values. The usual assumptions that the DF are frozen in, that the large-scale radial variation can be separated from the DF, that the DF power spectrum is a power law with outer scale k sub 0 and that the DF are homogeneous on scales less than 2c delta t, delta t = sample time, are made. The result agrees quite well with previous observations of DN. Corrections for the finite number of points used in the actual algorithm are discussed.

Callahan, P. S.↗

Numerical modeling of turbulent flow in a channel

Two-dimensional incompressible turbulent flow in a channel with a backward-facing step was studied numerically by Chorin's Random Vortex Method (RVM), an algorithm capable of tracing the action of elementary turbulent eddies and their cumulative effects without imposing any restrictions upon their motions. The step occurs in one side of a channel with otherwise flat, parallel walls; its height equals 1/3, 1/4 or 1/5 the width of the channel downstream. The main objective was to investigate the behavior of the large-scale turbulent eddies in a flow and the flow characteristics in the separated shear layer, the reattached zone, and the rebuilding boundary layer after reattachment. The unsteady vorticity field and the distribution of time-averaged turbulent statistics were obtained. The effects of expansion step height and initial boundary layer state were also studied. Comparisons were made with the available experimental results. The agreement is satisfactory in the velocity profiles and in the reattachment length, and fairly good in the turbulence profiles. Also a mechanism of the development of the reattaching turbulent flow was suggested by the numerical results.

Dai, Y. W.↗

Lunar and Planetary Surface Dynamics and Early History

This document, submitted as part of this proposal renewal represents the Final Report required by NASA for Grant NAGS-9442. It should be emphasized that, while this work statement in the original proposal outlined anticipated directions of our research, the specific activities we carried out during this period differed slightly from those proposed, capitalizing on new unexpected results and new advances in analytical capability. The thrust of all the work we completed were completely within the stated research goals of the proposal and significantly advanced our knowledge of planetary processes and our understanding of the early solar system. The following summary outlines our achievements in the different areas of research. These include: A) Early solar system processes and time scales using I-Xe chronometry; B) The Active Capture of Volatiles: A new mechanism for the capture of heavy noble gases, possible implications for phase Q and planetary heavy noble gases; C) Separation of Xe-L from Xe-H: Physically selective experiments; D) Abundances of Presolar grains; E) Studies of Neon and Helium from single interstellar SiC and graphite grains; F) Pre-compaction exposure of meteoritic grains and chondrules; G) Geochemically Measured Half-Lives: Double beta-decay of Te and Ba isotopes; H) Noble gases in stratospheric interplanetary dust particles; I) New Analytical Instrument.

Source record↗

Relative Ages of the Highlands, Lowlands, and Transition Zone Along a Portion of the Mars Crustal Dichotomy from Densities of Visible and Buried Impact Craters

Understanding the fundamental age relationships of the different parts of the Mars Crustal Dichotomy is essential to fully understanding the events that shaped the early history and formation of the surface of Mars. A dominant question is what are the true relative ages of the Northern Lowlands and the Southern Highlands? Using MOLA data from the Mars Global Surveyor and Viking visual images, a dataset of both buried and visible crater diameters was created over a nine million sq km study area of a section of the dichotomy boundary stretching from Arabia Terra to Utopia Planitia. Cumulative frequency plots on a log-log scale were used to determine the relative ages for the Highlands, the Lowlands, and the Transition Zone, separately for the visible, the buried and the combined total (visible+ buried) populations. We find the overall Highland crater population in this area is slightly older than the Lowlands, consistent with previous global studies, but the Lowlands and Transition Zone are also very old and formed at roughly the same time. It appears that the formation of the Lowlands in this region formed contemporaneously with a large-scale resurfacing event in the Highlands, perhaps caused by the process responsible for the Lowland formation.

DeSoto, G. E.↗

Stiff neural ordinary differential equations

Neural Ordinary Differential Equations (ODEs) are a promising approach to learn dynamical models from time-series data in science and engineering applications. This work aims at learning neural ODEs for stiff systems, which are usually raised from chemical kinetic modeling in chemical and biological systems. We first show the challenges of learning neural ODEs in the classical stiff ODE systems of Robertson’s problem and propose techniques to mitigate the challenges associated with scale separations in stiff systems. We then present successful demonstrations in stiff systems of Robertson’s problem and an air pollution problem. The demonstrations show that the usage of deep networks with rectified activations, proper scaling of the network outputs as well as loss functions, and stabilized gradient calculations are the key techniques enabling the learning of stiff neural ODEs. The success of learning stiff neural ODEs opens up possibilities of using neural ODEs in applications with widely varying time-scales, such as chemical dynamics in energy conversion, environmental engineering, and life sciences.

97 MATHEMATICS AND COMPUTING↗