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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 145 records · Page 8

Metagenome-assembled genomes from topsoils collected during NEON campaign in East River, CO (06/14/2018-06/28/2018)

The Watershed Function Science Focus Area (WF SFA) at Lawrence Berkeley National Lab is working to build a mechanistic understanding of the distribution and dynamics of biogeochemical processes in mountainous watersheds and their response to perturbation. In June 2018, the NEON (National Ecological Observatory Network) Airborne Observatory Platform (AOP) performed a taskable airborne imaging campaign to collect visible to shortwave infrared (VSWIR) imaging spectroscopy and LiDAR data across 330 km2 in the Upper East River at Crested Butte, CO. We conducted a parallel ground sampling campaign to sample vegetation traits, as well as soil physical, chemical, and microbiological characteristics. We collected these samples from 438 sites across 12 locations spanning much of the elevation, topographic, and geologic variability across the study area. A subset of 250 samples were used for soil metagenomics which is presented here. In addition, at each site, vegetation samples were collected to measure species-specific leaf water content and leaf mass area, foliar elemental composition and foliar CN stable isotope ratios. Soil samples were collected to measure soil physical properties which include bulk density and soil texture analysis. A suite of soil chemical properties was measured from the samples collected at each site, including pH, organic matter, concentrations exchangeable cations, total elemental composition, and the concentrations of extractable N pools (e.g. total free amino acids, ammonium, nitrate, dissolved organic N, and total dissolved N). Additionally, we have measured soil microbial biomass CN stoichiometry. Here, we present 1982 metagenome-assembled genomes (MAGs) for the bacterial and archaeal community from topsoil collected from during NEON 2018 campaign. All metagenomes were sequenced at JGI (Joint Genome Institute) (GOLD Study ID: Gs0149986). Metagenomes were assembled using JGI Metagenome Workflow (10.1128/mSystems.00804-20). The dataset includes (1) zip files for 1982 MAG fasta files (neon_genomes1-5.tar.gz, split into 5 tarballs to keep tarballs under 0.5 GB), (2) neon_Gs0149986_samples_soilproperties_metagenomes.csv: the sample information together with the accession numbers for the underlying metagenomes and the associated soil physical and chemical measurements in NMDC (National Microbiome Data Collaborative) compliant format, (3) neon_Gs0149986.kml: location bounding box file for the sampled locations, (4) samples.csv: sample metadata file used to register Internationall Generic Sample Numbers (IGSNs), (5) flmd.csv: file level metadata file, and (6) dd.csv: data dictionary file. This work was supported by the Watershed Function Science Focus Area at Lawrence Berkeley National Laboratory funded by the US Department of Energy, Office of Science, Biological and Environmental Research under Contract No. DE-AC02-05CH11231.

2018 NEON and 2025 CHESS Campaigns↗

Effect of amine type on acidic toxic gas adsorption at ambient conditions on modified CuBTC

We report two amine-modified copper-based Metal Organic Frameworks (MOF (CuBTC)) of different surface chemical and textural features were synthesized and used as adsorbents of acidic toxic gases (NO 2 and H 2 S) in both moist (71% relative humidity (R.H.)) and dry conditions. The initial and exhausted samples were characterized by nitrogen adsorption, powder X-ray diffraction, scanning electron microscopy, thermal gravimetric analysis and Fourier transform infrared spectroscopy. The addition of melamine prevented full growth of CuBTC crystals and resulted in amorphous-like particles with sizes less than 200 nm. The material was non-porous with a small surface area. When urea was used as an amine source, the resulting particles maintained the overall octahedral shape of the parent CuBTC MOF and the material was more porous than the parent MOF. While the urea-modified CuBTC sample performed well as an NO 2 adsorbent in the presence of moisture, the reactivity of the melamine-modified sample and its physical properties provided a favorable environment for the removal of H 2 S. The incorporation of amines into the MOF structure also resulted in surface defects /open copper sites that favored the removal of toxic gases in dry conditions. The reactivity of the adsorbents with toxic gases was demonstrated by the changes in the adsorbent colors, in texture, and in surface chemistry (organic salts, complexes, sulfides and nitrates were formed).

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Autonomous x-ray scattering

Autonomous experimentation (AE) is an emerging paradigm that seeks to automate the entire workflow of an experiment, including—crucially—the decision-making step. Beyond mere automation and efficiency, AE aims to liberate scientists to tackle more challenging and complex problems. We describe our recent progress in the application of this concept at synchrotron x-ray scattering beamlines. We automate the measurement instrument, data analysis, and decision-making, and couple them into an autonomous loop. We exploit Gaussian process modeling to compute a surrogate model and associated uncertainty for the experimental problem, and define an objective function exploiting these. We provide example applications of AE to x-ray scattering, including imaging of samples, exploration of physical spaces through combinatorial methods, and coupling to in situ processing platforms These uses demonstrate how autonomous x-ray scattering can enhance efficiency, and discover new materials.

77 NANOSCIENCE AND NANOTECHNOLOGY↗

Dynamical tuning of the chemical potential to achieve a target particle number in grand canonical Monte Carlo simulations

We present a method to facilitate Monte Carlo simulations in the grand canonical ensemble given a target mean particle number. The method imposes a fictitious dynamics on the chemical potential, to be run concurrently with the Monte Carlo sampling of the physical system. Corrections to the chemical potential are made according to time-averaged estimates of the mean and variance of the particle number, with the latter being proportional to thermodynamic compressibility. Here, we perform a variety of tests, and in all cases find rapid convergence of the chemical potential—inexactness of the tuning algorithm contributes only a minor part of the total measurement error for realistic simulations.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

SpectralFly: Ramanujan Graphs as Flexible and Efficient Interconnection Networks

In recent years, graph theoretic considerations have become increasingly important in the design of HPC interconnection topologies. One approach is to seek optimal or near-optimal families of graphs with respect to a particular graph theoretic property, such as diameter. For example, the SlimFly topology is based on a construction of McKay, Miller, and \v{S}ir\'{a}\v{n} which produces a diameter two graph on a number of nodes approaching the Moore bound, i.e. the largest possible diameter two graph with a fixed radix. Motivated by recent work of Aksoy, Bruillard, Young, and Raugas, we consider topologies which optimize the spectral gap rather than the diameter. In particular, we introduce a novel HPC topology, SpectralFly, designed around the Ramanujan graph construction of Lubotzky, Phillips, and Sarnak (LPS). In this work, we show that the combinatorial properties, such as diameter, bisection bandwidth, average path length, and resilience to link failure, of SpectralFly topologies are better than, or comparable to, similarly constrained DragonFly, SlimFly, and BundleFly topologies. Additionally, we simulate the performance of SpectralFly topologies on a representative sample of physics-inspired HPC workloads using the Structure Simulation Toolkit Macroscale Element Library simulator and demonstrate considerable benefit to using LPS construction as the basis of the SpectralFly topology.

graphs and networks, network topology, interconnec↗

Greedy Latent Space Dynamics Identification

This is a variant of LaSDI where it minimizes both reconstruction loss terms of auto encoder and dynamics regression loss terms simultaneously. Plus, an active learning framework is adopted so that a physics-informed greedy sampling point can be added to enhance the performance of gLaSDI. It is written in python and several examples are included in this software.

He, Xiaolong↗

Broadband rapid-scanning phase-modulated Fourier transform electronic spectroscopy

We present a phase-modulated approach for ultrabroadband Fourier transform electronic spectroscopy. To overcome the bandwidth limitations and spatial chirp introduced by acousto-optic modulators (AOMs), pulses from a 1 µm laser are modulated using AOMs prior to continuum generation. This phase modulation is transferred to the continuum generated in a yttrium aluminum garnet crystal. Separately generated phase-modulated continua in two arms of a Mach-Zehnder interferometer interfere with the difference of their modulation frequencies, enabling physical under-sampling of the signal and the suppression of low-frequency noise. By interferometrically tracking the relative time delay of the continua, we perform continuous, rapid-scanning Fourier transform electronic spectroscopy with a high signal-to-noise ratio and spectral resolution. As proof of principle, we measure the linear absorption and fluorescence excitation spectra of a laser dye and various biological samples.

Javed, Ariba↗

Results for Gamma-Ray Spectroscopy Characterization of Residual Radioactivity on Personal Protective Clothing

In early 2019, Health Physics Services (HPS) personnel put together a test plan to use the shielded gamma-ray spectroscopy instruments in the Health Physics Services Technical Laboratory (HPSTL) to perform a series of measurements on laundered personal protective clothing used in radiological areas at the Savannah River Site (SRS). That test plan describes the methodology used to determine the quantities of laundry to be obtained from operational facilities, the methods for quality control checking the instruments throughout the measurement period, and the physical arrangement of samples in the counting shields. The test plan is documented in SRNS-J6700-2019-00037 (Reference 1).

61 RADIATION PROTECTION AND DOSIMETRY↗

ICARUS at the Short-Baseline Neutrino Program: First Results

First results from ICARUS experiment are presented at FNAL. The selection of nu_mu CC events with 1muon+ N Protons from BNB targeted at numu disappearance analysis is presented for a subset of the collected statistics, , compared with MC predictions. A similar selection of nu_mu CC events 1muon+ N Protons + 0 pions in the NuMI beam aiming at the neutrino-Argon cross section measurement is also presented, together with a control sideband requiring in addition at least a pion candidate. Finally the result of a BSM search for a new particle decaying into two muons is also presented, showing no evidence within the studied sample of new physics.

43 PARTICLE ACCELERATORS↗

Quantitation of buried contamination by use of solvents

Solubilization studies were carried out on various cured silicone resins. A solvent spectrum was prepared. It was found that complete dissolution of cured silicone resins could be achieved without extensive physical degradation of samples. Based on the solubilization results, amine solvents were selected for spore viability studies.

Pappas, S. P.↗

Evaluation of low cost/high temperature fiber and blanket insulation

Twelve fiber materials comprising water-felted fiber cakes and blanket insulation were subjected to furnace exposures at 1000, 1200, 1400, and 1600 C for up to 500 hours to establish the time-temperature limits below which these insulation materials can withstand repeated thermal cycles without detrimental shrinkage, thermal conductivity increase, or physical changes. Test samples were inspected periodically during the exposure cycles and weight loss and dimensional shrinkage were measured. Density, fiber crystallography, and thermal conductivity were measured after exposure and properties were compared with those of unexposed controls.

Strauss, E. L.↗

High-speed machining of space shuttle External Tank (ET) panels

The applicability to and advantages of the high-speed machining process for the production of Space Shuttle external tank panels by physically machining selected sample portions of an external tank panel were investigated. The panel sample configuration was selected, and potential high speed milling procedures identified. An 8 foot long panel was machined and the milling demonstration is described in detail.

Miller, J. A.↗

Microgravity Science in Space Flight Gloveboxes

Microgravity science studies the influences of gravity on phenomena in fluids, materials processes, combustion, and human cell growth in the low acceleration environment of space flight. During the last decade, the accomplishment of the flight research in the field has evolved into an effective cooperation between the flight crew in the Shuttle and the ground-based investigator using real-time communication via voice and video links. This team structure has led to interactive operations in which the crew performs the experimentation while guided, as necessary, by the science investigator who formulated the investigation and who will subsequently interpret and analyze the data. One of the primary challenges to implementing this interactive research has been the necessity of structuring a means of handling fluids, gases, and hazardous materials in a manned laboratory that exhibits the novelty of weightlessness. Developing clever means of designing experiments in closed vessels is part of the solution- but the space flight requirement for one and two failure-tolerant containment systems leads to serious complications in the physical handling of sample materials. In response to the conflict between the clear advantage of human operation and judgment, versus the necessity to isolate the experiment from the crewmember and the spacecraft environment, the Microgravity Research Program has initiated a series of Gloveboxes in the various manned experiment carriers. These units provide a sealed containment vessel whose interior is under a negative pressure with respect to the ambient environment but is accessible to a crewmember through the glove ports.

Baugher, Charles↗

Smart Networked Elements in Support of ISHM

At the core of ISHM is the ability to extract information and knowledge from raw data. Conventional data acquisition systems sample and convert physical measurements to engineering units, which higher-level systems use to derive health and information about processes and systems. Although health management is essential at the top level, there are considerable advantages to implementing health-related functions at the sensor level. The distribution of processing to lower levels reduces bandwidth requirements, enhances data fusion, and improves the resolution for detection and isolation of failures in a system, subsystem, component, or process. The Smart Networked Element (SNE) has been developed to implement intelligent functions and algorithms at the sensor level in support of ISHM.

Oostdyk, Rebecca↗

Thermal Testing of Woven TPS Materials in Extreme Entry Environments

NASAs future robotic missions to Venus and outer planets, namely, Saturn, Uranus, Neptune, result in extremely high entry conditions that exceed the capabilities of current mid density ablators (PICA or Avcoat). Therefore mission planners assume the use of a fully dense carbon phenolic heatshield similar to what was flown on Pioneer Venus and Galileo. Carbon phenolic (CP) is a robust TPS however its high density and thermal conductivity constrain mission planners to steep entries, high heat fluxes, high pressures and short entry durations, in order for CP to be feasible from a mass perspective. In 2012 the Game Changing Development Program in NASAs Space Technology Mission Directorate funded NASA ARC to investigate the feasibility of a Woven Thermal Protection System to meet the needs of NASAs most challenging entry missions. The high entry conditions pose certification challenges in existing ground based test facilities. Recent updates to NASAs IHF and AEDCs H3 high temperature arcjet test facilities enable higher heatflux (2000 Wcm2) and high pressure (5 atm) testing of TPS. Some recent thermal tests of woven TPS will be discussed in this paper. These upgrades have provided a way to test higher entry conditions of potential outer planet and Venus missions and provided a baseline against carbon phenolic material. The results of these tests have given preliminary insight to sample configuration and physical recession profile characteristics.

TPS↗

Jet-Surface Interaction Test: Flow Measurements Results

Modern aircraft design often puts the engine exhaust in close proximity to the airframe surfaces. Aircraft noise prediction tools must continue to develop in order to meet the challenges these aircraft present. The Jet-Surface Interaction Tests have been conducted to provide a comprehensive quality set of experimental data suitable for development and validation of these exhaust noise prediction methods. Flow measurements have been acquired using streamwise and cross-stream particle image velocimetry (PIV) and fluctuating surface pressure data acquired using flush mounted pressure transducers near the surface trailing edge. These data combined with previously reported far-field and phased array noise measurements represent the first step toward the experimental data base. These flow data are particularly applicable to development of noise prediction methods which rely on computational fluid dynamics to uncover the flow physics. A representative sample of the large flow data set acquired is presented here to show how a surface near a jet affects the turbulent kinetic energy in the plume, the spatial relationship between the jet plume and surface needed to generate surface trailing-edge noise, and differences between heated and unheated jet flows with respect to surfaces.

Flow↗

Path sampling of recurrent neural networks by incorporating known physics

Recurrent neural networks have seen widespread use in modeling dynamical systems in varied domains such as weather prediction, text prediction and several others. Often one wishes to supplement the experimentally observed dynamics with prior knowledge or intuition about the system. While the recurrent nature of these networks allows them to model arbitrarily long memories in the time series used in training, it makes it harder to impose prior knowledge or intuition through generic constraints. In this work, we present a path sampling approach based on principle of Maximum Caliber that allows us to include generic thermodynamic or kinetic constraints into recurrent neural networks. We show the method here for a widely used type of recurrent neural network known as long short-term memory network in the context of supplementing time series collected from different application domains. These include classical Molecular Dynamics of a protein and Monte Carlo simulations of an open quantum system continuously losing photons to the environment and displaying Rabi oscillations. Our method can be easily generalized to other generative artificial intelligence models and to generic time series in different areas of physical and social sciences, where one wishes to supplement limited data with intuition or theory based corrections.

59 BASIC BIOLOGICAL SCIENCES↗

Implicit quantile networks for emulation in jet physics

Abstract The ability to model and sample from conditional densities is important in many physics applications. Implicit quantile networks (IQN) have been successfully applied to this task in domains outside physics. In this work, we illustrate the potential of IQNs as components of emulators using the simulation of jets as an example. Specifically, we use an IQN to map jets described by their 4-momenta at the generation level to jets at the event reconstruction level. The conditional densities emulated by our model closely match those generated by Delphes , while also enabling faster jet simulation.

Kronheim, Braden (ORCID:0000000307040972)↗