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At least 919 records · Page 51

Probing the decelerating trajectory of a Raman soliton using temporal reflection

Temporal reflection is a process where an optical pulse reflects off a moving boundary with different refractive indices across it. In a dispersive medium, this process creates a reflected pulse with a frequency shift that changes its speed. Such frequency shifts depend on the speed of the moving boundary. In this work, we propose and experimentally show that it is possible to probe the trajectory of the boundary by measuring the frequency shifts while changing the initial delay between the incident pulse and the boundary. We demonstrate this effect by reflecting a probe pulse off a short soliton, acting as a moving boundary that decelerates inside a photonic crystal fiber because of intrapulse Raman scattering. We deduce trajectory of the soliton from the measured spectral data for the reflected pulse.

47 OTHER INSTRUMENTATION↗

Electro-optic sampling of classical and quantum light

Full characterization of electric-field waveforms in amplitude and phase is achieved across the terahertz to visible spectral range through interaction with an optical pulse shorter than a half-cycle period via the Pockels (linear electro-optic) effect. This technique of electro-optic sampling has become an indispensable tool in various areas, including ultrafast pump-probe, time-domain and frequency-comb spectroscopies, quantum optics, high-harmonic generation, and attosecond science, and holds great promise for further advances. Not only does it enable spectroscopic measurements with record dynamic range and temporal resolution, along with massively parallel real-time spectral data acquisition, but its remarkable sensitivity also allows the detection of vacuum fluctuations, i.e., “zero-point motion” of electric fields, profoundly impacting our understanding of the fundamental laws of nature.

Benea-Chelmus, Ileana-Cristina (ORCID:000000024814↗

Imaging spectroscopy algorithms for mapping canopy foliar chemical and morphological traits and their uncertainties

A major goal of remote sensing is the development of generalizable algorithms to repeatedly and accurately map ecosystem properties across space and time. Imaging spectroscopy has great potential to map vegetation traits that cannot be retrieved from broadband spectral data, but rarely have such methods been tested across broad regions. Here we illustrate a general approach for estimating key foliar chemical and morphological traits through space and time using NASA's Airborne Visible/Infrared Imaging Spectrometer (AVIRIS-Classic). We apply partial least squares regression (PLSR) to data from 237 field plots within 51 images acquired between 2008 and 2011. Using a series of 500 randomized 50/50 subsets of the original data, we generated spatially explicit maps of seven traits (leaf mass per area (M area ), percentage nitrogen, carbon, fiber, lignin, and cellulose, and isotopic nitrogen concentration, δ 15 N) as well as pixel-wise uncertainties in their estimates based on error propagation in the analytical methods. Both Marea and %N PLSR models had a R 2 > 0.85. Root mean square errors (RMSEs) for both variables were less than 9% of the range of data. Fiber and lignin were predicted with R 2 > 0.65 and carbon and cellulose with R 2 > 0.45. Although R 2 of %C and cellulose were lower than Marea and %N, the measured variability of these constituents (especially %C) was also lower, and their RMSE values were beneath 12% of the range in overall variability. Model performance for δ 15 N was the lowest (R 2 = 0.48, RMSE = 0.95‰), but within 15% of the observed range. The resulting maps of chemical and morphological traits, together with their overall uncertainties, represent a first-of-its-kind approach for examining the spatiotemporal patterns of forest functioning and nutrient cycling across a broad range of temperate and sub-boreal ecosystems. These results offer an alternative to categorical maps of functional or physiognomic types by providing non-discrete maps (i.e., on a continuum) of traits that define those functional types. A key contribution of this work is the ability to assign retrieval uncertainties by pixel, a requirement to enable assimilation of these data products into ecosystem modeling frameworks to constrain carbon and nutrient cycling projections.

54 ENVIRONMENTAL SCIENCES↗

Experiments with the LECO Pegasus® Gas Chromatograph/ Time-of-Flight Mass Spectrometer Phase 2: 2D Fast GC Separations

Conventional analysis by gas chromatography/ quadrupole mass spectrometry (GC/MS) can be time-consuming (30 – 60 minutes) and prone to interferences. The use of fast gas chromatography coupled with time-of-flight mass spectrometry (GC/TOF-MS) offers the advantages of faster (~10 min) analysis times, improved GC resolution afforded by the use of narrower (0.1– 0.18 mm id) columns, and improved mass resolution and scan speed provided by the TOF-MS. In addition, GC/TOF-MS offers the promise of better instrument detection limits than quadrupole GC/MS, while still providing full mass spectral data. If the GC/TOF-MS can be operated to perform two-dimensional (2D) separations, the ability to resolve peaks of interest from interfering compounds is improved. In 2D chromatography, a second GC column with a different chemical phase than that of the first GC column is used to provide additional separation of analytes as they elute from the first column. Because the chemistry of the second GC column is different from the first, compounds that co-elute from the first column may be easily resolved after a separation on the second GC column (i.e., the peak capacity of the system is increased and the specificity of analyte detection is improved).

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Annual Report X-GAMMA: Revealing the Nuclear Fingerprint with Cryogenic Detectors

Technical work in the area of gamma-ray spectroscopy based on ultra-high resolution microcalorimeter spectrometers has focused on three areas: (1) In depth study of the sources of systematic uncertainty, (2) hardware upgrades to increase the stability and speed of spectrometer operation, and (3) measuring plutonium-containing SNM samples to test the hardware system and to inform further development of our spectral data analysis tools and methods.

47 OTHER INSTRUMENTATION↗

Tank 9H Salt Solution Supernatant Characterization in Support of Potential Operating Strategies of Tank 9H Supernatant Through the Tank Closure Cesium Removal System

Savannah River Remediation (SRR) recently initiated an ion exchange process to remove radioactive cesium from dissolved salt solution in Tank 10H, known as Tank Closure Cesium Removal (TCCR). As part of that ongoing campaign, the salt in Tank 9H will be dissolved and transferred to Tank 10H for processing through the TCCR system, and SRR requested the characterization of the dissolved salt solution in Tank 9H prior to the transfer to Tank 10H. On July 18, 2019, Savannah River Remediation Engineering (SRR-E) delivered two variable depth Tank 9H salt solution samples, identified as samples HTF-9-19-74 and HTF-9-19-75 (combined total sample volume of about 400 mL) to the Savannah River National Laboratory (SRNL) for characterization. These two Tank 9H variable depth samples (HTF-9-19-74 and HTF-9-19-75 taken at ~180” and 42”, respectively) were retrieved from Riser 7 after hydro-lancing activities were complete. Approximately 4200 gallons of water were added to the tank during this activity. This report presents the analytical characterization results for the Tank 9H salt solution variable depth samples HTF-9-19-74 and HTF-9-19-75 and contains mainly the filtrate analytical results for anions, elements, mass spectral data, total cesium characterization results and select radionuclide results, along with the X-ray diffraction characterization of the solid fractions from the liquid /solid separation of the variable depth salt solutions. Most of these analyses were performed in duplicate with the percent relative standard deviation (%RSD), a measure of the variability between each duplicate data set expressed as a percentage, used to estimate the analytical result quality for each analyte.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Neutron spectral measurements at the BNL NSLS-II synchrotron facility

During the first week of August 2022, Tim Gildea of Los Alamos National Laboratory’s (LANL) RP-SVS group performed a series of neutron spectral measurements at the National Synchrotron Light Source II (NSLS-II) 3GeV facility located at Brookhaven National Lab (BNL)1 . These measurements were conducted under Memorandum Purchase Order (MPO) 413911 with the objective of gaining an accurate understanding of the photoneutron fields generated under normal and selected fault conditions. The spectral data collected during the course of the study was analyzed at LANL and the results form the basis of this report.

61 RADIATION PROTECTION AND DOSIMETRY↗

Autonomous Flow Electrochemistry for Accelerated Catalyst Discovery

Our objective is to develop an Autonomous Chemical Experimentation (ACE) platform that accelerates discovery of new catalytic transformations and other energy-relevant chemical reactions and processes. We intentionally designed ACE to be highly modular, both with respect to its rapid deployment to different chemistries and experimental workflows as well as incorporation of a wide range of different AI algorithms. In addition to the development of the core software architecture, initial efforts were made to incorporate Large Language Models to provide human-interpretable reasoning of the optimizer’s actions, and to develop a user-friendly graphical interface for experimental researchers. ACE was demonstrated using a flow electrocatalysis platform containing an inline FTIR spectrometer for real-time analysis and quantification of the reaction outcome. Human-in-the-loop experiments were performed in which a human researcher conducted an experiment using electrode potentials suggested by ACE, then fed the spectral data back to ACE for decision making. After confirming the successful function of the optimizer, efforts were next directed to automation of the hardware and performed full autonomy tests using three reactions: catalytic oxidation of formate, catalytic oxidation of cyclohexanol, and oxidation of hydroquinone. These studies confirm that ACE can close the loop between reaction execution, analysis, and optimization. They also reveal that more improved product detection methods will be essential for ACE to make well-informed decisions for reactions with low conversions.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

SPRUCE Hyperspectral Remote Sensing of Vegetation Communities in SPRUCE Experimental Plots, 2016

This dataset consists of reflectance observations from hyperspectral remote sensing of the vegetation communities from the Spruce and Peatland Responses Under Changing Environments (SPRUCE) experimental site within the Marcell Experimental Forest in northern Minnesota, USA. Observations were collected in SPRUCE experimental study plots located in the S1-Bog. Community vegetation plots in ten chambered treatment plots (6, 19, 11, 20, 4, 13, 8, 16, 10, 17) and 3 unchambered ambient plots (7, 14, 21) were scanned. Spectral data were collected on 22 September 2016 (2016-09-22) under clear sky conditions beginning at 1:00 p.m. local time (Central Standard Time). Although it was past peak growing season, senescence had only just begun at the site, and experimentally warmed plots were still near peak growing conditions. Data collection was performed using a PP Systems UniSpec-DC spectroradiometer that detected incoming and reflected solar radiation in 3–4 nm bandwidths between 310 and 1100 nm. The fiber optic cable on the Unispec was fitted with a field of view (FOV) restrictor that limited the FOV to approximately 15°. The instrument foreoptic was leveled at 1 m above the ground capturing an area of approximately 35 cm in diameter, or 0.1 m2. White reference scans were performed between each treatment. Bands at the beginning and end of the spectrum were eliminated due to noise, resulting in a reported data range of 400-1000 nm. These data can help characterize boreal peatland plant composition and species diversity and their responses to elevated temperatures and carbon dioxide concentrations. These observations were used in analyses in McPartland et al (2019). This dataset contains 4 data files in comma-separate values (*.csv) format. Additional metadata are provided: four data dictionaries and a file-level metadata file in comma-separate values (.csv) format and a user guide in PDF (*.pdf) format.

54 ENVIRONMENTAL SCIENCES↗

Sustainability Trait Modeling of Field-Grown Switchgrass (Panicum virgatum) Using UAV-Based Imagery

Unmanned aerial vehicles (UAVs) provide an intermediate scale of spatial and spectral data collection that yields increased accuracy and consistency in data collection for morphological and physiological traits than satellites and expanded flexibility and high-throughput compared to ground-based data collection. In this project, we used UAV-based multispectral imagery collected from MicaSense RedEdge-M on a DJI Matrice 600 Pro for automated phenotyping of field-grown switchgrass (Panicum virgatum), a leading bioenergy feedstock. The raw images were processed with Pix4D Mapper to create the reflectance data, and vegetation indices were calculated from a UAV-based multispectral camera. Statistical models were developed for rust disease caused by Puccinia novopanici, leaf chlorophyll, nitrogen, and lignin contents. For the first time, UAV remote sensing technology was used to explore the potential for multiple traits associated with sustainable production of switchgrass. One statistical model was developed for each individual trait based on the statistical correlation between vegetation indices and the corresponding trait.

CBI↗

Evaluating lignocellulosic biomass, its derivatives, and downstream products with Raman spectroscopy

The creation of fuels, chemicals, and materials from plants can aid in replacing products fabricated from non-renewable energy sources. Before using biomass in downstream applications, it must be characterized to assess chemical traits, such as cellulose, lignin, or lignin monomer content, or the sugars released following an acid or enzymatic hydrolysis. The measurement of these traits allows researchers to gage the recalcitrance of the plants and develop efficient deconstruction strategies to maximize yields. Standard methods for assessing biomass phenotypes often have experimental protocols that limit their use for screening sizeable numbers of plant species. Raman spectroscopy, a non-destructive, non-invasive vibrational spectroscopy technique, is capable of providing qualitative, structural information and quantitative measurements. Applications of Raman spectroscopy have aided in alleviating the constraints of standard methods by coupling spectral data with multivariate analysis to construct models capable of predicting analytes. Hydrolysis and fermentation products, such as glucose and ethanol, can be quantified off-, at-, or on-line. Raman imaging has enabled researchers to develop a visual understanding of reactions, such as different pretreatment strategies, in real-time, while also providing integral chemical information. Finally, this review provides an overview of what Raman spectroscopy is, and how it has been applied to the analysis of whole lignocellulosic biomass, its derivatives, and downstream process monitoring.

09 BIOMASS FUELS↗

Influence of Time and Frequency Domain Wave Forcing on the Power Estimation of a Wave Energy Converter Array

Industry-specific tools for analyzing and optimizing the design of wave energy converters (WECs) and associated power systems are essential to advancing marine renewable energy. This study aims to quantify the influence of phase information on the device power output of a virtual WEC array. We run the phase-resolving wave model FUNWAVE-TVD (Total Variation Diminishing) to generate directional waves at the PacWave South site offshore from Newport, Oregon, where future WECs are expected to be installed for testing. The two broad cases presented correspond to mean wave climates during warm months (March–August) and cold months (September–February). FUNWAVE-TVD time series of sea-surface elevation are then used in WEC-Sim, a time domain numerical model, to simulate the hydrodynamic response of each device in the array and estimate their power output. For comparison, WEC-Sim is also run with wave energy spectra calculated from the FUNWAVE-TVD simulations, which do not retain phase information, and with wave spectra computed using the phase-averaged model Simulating WAves Nearshore (SWAN). The use of spectral data in WEC-Sim requires a conversion from frequency to time domain by means of random superposition of wave components, which are not necessarily consistent because of the linear assumption implicit in this method. Thus, power response is characterized by multiple realizations of the wave climates.

13 HYDRO ENERGY↗

Isolation, Structural Analysis and Biological Activity Assays of Biselisabethoxanes A and B: Two Dissymmetric Bis-Diterpenes from the Southwestern Caribbean Sea Gorgonian Coral Pseudopterogorgia elisabethae

Two novel dissymmetric diterpenoids, biselisabethoxanes A and B (1 and 2), were isolated from the hexane extracts of the gorgonian coral Pseudopterogorgia elisabethae. Biselisabethoxane A (1) represents the first example of a marine-derived C40 dimer made of two distinct diterpene fragments, whereas biselisabethoxane B (2) is a fused heterodimer stemming from coupling of two amphilectane-based fragments. The structures of 1 and 2 were elucidated based on 1D and 2D NMR spectral data analysis. The molecular structure of 1 was subsequently confirmed by X-ray crystallographic analysis. When evaluated for their inhibitory effects in a series of well-established biological activity assays the isolated compounds were shown to moderately inhibit the growth of Mycobacterium tuberculosis.

59 BASIC BIOLOGICAL SCIENCES↗

Sustainability Trait Modeling of Field-Grown Switchgrass ( Panicum virgatum ) Using UAV-Based Imagery

Unmanned aerial vehicles (UAVs) provide an intermediate scale of spatial and spectral data collection that yields increased accuracy and consistency in data collection for morphological and physiological traits than satellites and expanded flexibility and high-throughput compared to ground-based data collection. In this study, we used UAV-based remote sensing for automated phenotyping of field-grown switchgrass (Panicum virgatum), a leading bioenergy feedstock. Using vegetation indices calculated from a UAV-based multispectral camera, statistical models were developed for rust disease caused by Puccinia novopanici, leaf chlorophyll, nitrogen, and lignin contents. For the first time, UAV remote sensing technology was used to explore the potentials for multiple traits associated with sustainable production of switchgrass, and one statistical model was developed for each individual trait based on the statistical correlation between vegetation indices and the corresponding trait. Also, for the first time, lignin content was estimated in switchgrass shoots via UAV-based multispectral image analysis and statistical analysis. The UAV-based models were verified by ground-truthing via correlation analysis between the traits measured manually on the ground-based with UAV-based data. The normalized difference red edge (NDRE) vegetation index outperformed the normalized difference vegetation index (NDVI) for rust disease and nitrogen content, while NDVI performed better than NDRE for chlorophyll and lignin content. Overall, linear models were sufficient for rust disease and chlorophyll analysis, but for nitrogen and lignin contents, nonlinear models achieved better results. As the first comprehensive study to model switchgrass sustainability traits from UAV-based remote sensing, these results suggest that this methodology can be utilized for switchgrass high-throughput phenotyping in the field.

60 APPLIED LIFE SCIENCES↗

FIRST RESULTS FROM THE RAPID-RESPONSE SPECTROPHOTOMETRIC CHARACTERIZATION OF NEAR-EARTH OBJECTS USING UKIRT

Using the Wide Field Camera for the United Kingdom Infrared Telescope (UKIRT), we measure the near-infrared colors of near-Earth objects (NEOs) in order to put constraints on their taxonomic classifications. The rapid-response character of our observations allows us to observe NEOs when they are close to the Earth and bright. Here we present near-infrared color measurements of 86 NEOs, most of which were observed within a few days of their discovery, allowing us to characterize NEOs with diameters of only a few meters. Using machine-learning methods, we compare our measurements to existing asteroid spectral data and provide probabilistic taxonomic classifications for our targets. Our observations allow us to distinguish between S-complex, C/X-complex, D-type, and V-type asteroids. Our results suggest that the fraction of S-complex asteroids in the whole NEO population is lower than the fraction of ordinary chondrites in the meteorite fall statistics. Future data obtained with UKIRT will be used to investigate the significance of this discrepancy.

79 ASTRONOMY AND ASTROPHYSICS↗

STELLAR NUCLEI AND INNER POLAR DISKS IN LENTICULAR GALAXIES

I analyze statistics of the stellar population properties for stellar nuclei and bulges of nearby lenticular galaxies in different environments by using panoramic spectral data of the integral-field spectrograph SAURON retrieved from the open archive of the Isaac Newton Group. I also estimate the fraction of nearby lenticular galaxies having inner polar gaseous disks by exploring the volume-limited sample of early-type galaxies of the ATLAS-3D survey. By inspecting the two-dimensional velocity fields of the stellar and gaseous components with the running tilted-ring technique, I have found seven new cases of inner polar disks. Together with those, the frequency of inner polar disks in nearby S0 galaxies reaches 10%, which is much higher than the frequency of large-scale polar rings. Interestingly, the properties of the nuclear stellar populations in the inner polar ring hosts are statistically the same as those in the whole S0 sample, implying similar histories of multiple gas-accretion events from various directions.

79 ASTRONOMY AND ASTROPHYSICS↗

MODELS OF THE η CORVI DEBRIS DISK FROM THE KECK INTERFEROMETER, SPITZER, AND HERSCHEL

Debris disks are signposts of analogs to small-body populations of the solar system, often, however, with much higher masses and dust production rates. The disk associated with the nearby star η Crv is especially striking, as it shows strong mid- and far-infrared excesses despite an age of ∼1.4 Gyr. We undertake constructing a consistent model of the system that can explain a diverse collection of spatial and spectral data. We analyze Keck Interferometer Nuller measurements and revisit Spitzer and additional spectrophotometric data, as well as resolved Herschel images, to determine the dust spatial distribution in the inner exozodi and in the outer belt. We model in detail the two-component disk and the dust properties from the sub-AU scale to the outermost regions by fitting simultaneously all measurements against a large parameter space. The properties of the cold belt are consistent with a collisional cascade in a reservoir of ice-free planetesimals at 133 AU. It shows marginal evidence for asymmetries along the major axis. KIN enables us to establish that the warm dust consists of a ring that peaks between 0.2 and 0.8 AU. To reconcile this location with the ∼400 K dust temperature, very high albedo dust must be invoked, and a distribution of forsterite grains starting from micron sizes satisfies this criterion, while providing an excellent fit to the spectrum. We discuss additional constraints from the LBTI and near-infrared spectra, and we present predictions of what James Webb Space Telescope can unveil about this unusual object and whether it can detect unseen planets.

79 ASTRONOMY AND ASTROPHYSICS↗

OBSERVATIONAL DETECTION OF DRIFT VELOCITY BETWEEN IONIZED AND NEUTRAL SPECIES IN SOLAR PROMINENCES

We report the detection of differences in the ion and neutral velocities in prominences using high-resolution spectral data obtained in 2012 September at the German Vacuum Tower Telescope (Observatorio del Teide, Tenerife). A time series of scans of a small portion of a solar prominence was obtained simultaneously with high cadence using the lines of two elements with different ionization states, namely, Ca ii 8542 Å and He i 10830 Å. The displacements, widths, and amplitudes of both lines were carefully compared to extract dynamical information about the plasma. Many dynamical features are detected, such as counterstreaming flows, jets, and propagating waves. In all of the cases, we find a very strong correlation between the parameters extracted from the lines of both elements, confirming that both lines trace the same plasma. Nevertheless, we also find short-lived transients where this correlation is lost. These transients are associated with ion-neutral drift velocities of the order of several hundred m s{sup −1}. The patches of non-zero drift velocity show coherence in time–distance diagrams.

79 ASTRONOMY AND ASTROPHYSICS↗