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At least 1,099 records · Page 61
All sourcesNASA NTRSDOE OSTI
DOE OSTI2025

Observation of a pseudoscalar excess at the top quark pair production threshold

A search for resonances in top quark pair ($t\overline{t}$) production in final states with two charged leptons and multiple jets is presented, based on proton–proton collision data collected by the CMS experiment at the CERN LHC at $\sqrt{s}$ = 13 TeV , corresponding to 138 fb −1 . The analysis explores the invariant mass of the $t\overline{t}$ system and two angular observables that provide direct access to the correlation of top quark and antiquark spins. A significant excess of events is observed near the kinematic $t\overline{t}$ threshold compared to the non-resonant production predicted by fixed-order perturbative quantum chromodynamics (pQCD). The observed enhancement is consistent with the production of a color-singlet pseudoscalar ($^1S^{[1]}_{0}$) quasi-bound toponium state, as predicted by non-relativistic quantum chromodynamics. Using a simplified model for $^1S^{[1]}_{0}$ toponium, the cross section of the excess above the pQCD prediction is measured to be $8.8^{+1.2}_{-1.4}$ pb.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2024

Surface-active antibiotic production as a multifunctional adaptation for postfire microorganisms

Abstract Wildfires affect soils in multiple ways, leading to numerous challenges for colonizing microorganisms. Although it is thought that fire-adapted microorganisms lie at the forefront of postfire ecosystem recovery, the specific strategies that these organisms use to thrive in burned soils remain largely unknown. Through bioactivity screening of bacterial isolates from burned soils, we discovered that several Paraburkholderia spp. isolates produced a set of unusual rhamnolipid surfactants with a natural methyl ester modification. These rhamnolipid methyl esters (RLMEs) exhibited enhanced antimicrobial activity against other postfire microbial isolates, including pyrophilous Pyronema fungi and Amycolatopsis bacteria, compared to the typical rhamnolipids made by organisms such as Pseudomonas spp. RLMEs also showed enhanced surfactant properties and facilitated bacterial motility on agar surfaces. In vitro assays further demonstrated that RLMEs improved aqueous solubilization of polycyclic aromatic hydrocarbons, which are potential carbon sources found in char. Identification of the rhamnolipid biosynthesis genes in the postfire isolate, Paraburkholderia kirstenboschensis str. F3, led to the discovery of rhlM, whose gene product is responsible for the unique methylation of rhamnolipid substrates. RhlM is the first characterized bacterial representative of a large class of integral membrane methyltransferases that are widespread in bacteria. These results indicate multiple roles for RLMEs in the postfire lifestyle of Paraburkholderia isolates, including enhanced dispersal, solubilization of potential nutrients, and inhibition of competitors. Our findings shed new light on the chemical adaptations that bacteria employ to navigate, grow, and outcompete other soil community members in postfire environments.

59 BASIC BIOLOGICAL SCIENCES↗
DOE OSTI2018

Planning of distributed data production for High Energy and Nuclear Physics

Modern experiments in High Energy and Nuclear Physics heavily rely on distributed computations using multiple computational facilities across the world. One of the essential types of the computations is a distributed data production where petabytes of raw files from a single source has to be processed once (per production campaign) using thousands of CPUs at distant locations and the output has to be transferred back to that source. The data distribution over a large system does not necessary match the distribution of storage, network and CPU capacity. Therefore, bottlenecks may appear and lead to increased latency and degraded performance. In this paper we propose a new scheduling approach for distributed data production which is based on the network flow maximization model. In our approach a central planner defines how much input and output data should be transferred over each network link in order to maximize the computational throughput. Such plans are created periodically for a fixed planning time interval using up-to-date information on network, storage and CPU resources. The centrally created plans are executed in a distributed manner by dedicated services running at participating sites. In conclusion, our simulations based on the log records from the data production framework of the experiment STAR (Solenoid Tracker at RHIC) have shown that the proposed model systematically provides a better performance compared to the simulated traditional techniques.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
NASA NTRS2011

SMOS/SMAP Synergy for SMAP Level 2 Soil Moisture Algorithm Evaluation

Soil Moisture Active Passive (SMAP) satellite has been proposed to provide global measurements of soil moisture and land freeze/thaw state at 10 km and 3 km resolutions, respectively. SMAP would also provide a radiometer-only soil moisture product at 40-km spatial resolution. This product and the supporting brightness temperature observations are common to both SMAP and European Space Agency's Soil Moisture and Ocean Salinity (SMOS) mission. As a result, there are opportunities for synergies between the two missions. These include exploiting the data for calibration and validation and establishing longer term L-band brightness temperature and derived soil moisture products. In this investigation we will be using SMOS brightness temperature, ancillary data, and soil moisture products to develop and evaluate a candidate SMAP L2 passive soil moisture retrieval algorithm. This work will begin with evaluations based on the SMOS product grids and ancillary data sets and transition to those that will be used by SMAP. An important step in this analysis is reprocessing the multiple incidence angle observations provided by SMOS to a global brightness temperature product that simulates the constant 40 degree incidence angle observations that SMAP will provide. The reprocessed brightness temperature data provide a basis for evaluating different SMAP algorithm alternatives. Several algorithms are being considered for the SMAP radiometer-only soil moisture retrieval. In this first phase, we utilized only the Single Channel Algorithm (SCA), which is based on the radiative transfer equation and uses the channel that is most sensitive to soil moisture (H-pol). Brightness temperature is corrected sequentially for the effects of temperature, vegetation, roughness (dynamic ancillary data sets) and soil texture (static ancillary data set). European Centre for Medium-Range Weather Forecasts (ECMWF) estimates of soil temperature for the top layer (as provided as part of the SMOS ancillary data) were used to correct for surface temperature effects and to derive microwave emissivity. ECMWF data were also used for precipitation forecasts, presence of snow, and frozen ground. Vegetation options are described below. One year of soil moisture observations from a set of four watersheds in the U.S. were used to evaluate four different retrieval methodologies: (1) SMOS soil moisture estimates (version 400), (2) SeA soil moisture estimates using the SMOS/SMAP data with SMOS estimated vegetation optical depth, which is part of the SMOS level 2 product, (3) SeA soil moisture estimates using the SMOS/SMAP data and the MODIS-based vegetation climatology data, and (4) SeA soil moisture estimates using the SMOS/SMAP data and actual MODIS observations. The use of SMOS real-world global microwave observations and the analyses described here will help in the development and selection of different land surface parameters and ancillary observations needed for the SMAP soil moisture algorithms. These investigations will greatly improve the quality and reliability of this SMAP product at launch.

Bindlish, Rajat↗
NASA NTRS2010

Ares I-X Range Safety Simulation Verification and Analysis IV and V

NASA s ARES I-X vehicle launched on a suborbital test flight from the Eastern Range in Florida on October 28, 2009. NASA generated a Range Safety (RS) flight data package to meet the RS trajectory data requirements defined in the Air Force Space Command Manual 91-710. Some products included in the flight data package were a nominal ascent trajectory, ascent flight envelope trajectories, and malfunction turn trajectories. These data are used by the Air Force s 45th Space Wing (45SW) to ensure Eastern Range public safety and to make flight termination decisions on launch day. Due to the criticality of the RS data in regards to public safety and mission success, an independent validation and verification (IV&V) effort was undertaken to accompany the data generation analyses to ensure utmost data quality and correct adherence to requirements. Multiple NASA centers and contractor organizations were assigned specific products to IV&V. The data generation and IV&V work was coordinated through the Launch Constellation Range Safety Panel s Trajectory Working Group, which included members from the prime and IV&V organizations as well as the 45SW. As a result of the IV&V efforts, the RS product package was delivered with confidence that two independent organizations using separate simulation software generated data to meet the range requirements and yielded similar results. This document captures ARES I-X RS product IV&V analysis, including the methodology used to verify inputs, simulation, and output data for an RS product. Additionally a discussion of lessons learned is presented to capture advantages and disadvantages to the IV&V processes used.

Tarpley, Ashley↗
DOE OSTI2015

Simultaneous detection of electronic structure changes from two elements of a bifunctional catalyst using wavelength-dispersive X-ray emission spectroscopy and in situ electrochemistry.

Multielectron catalytic reactions, such as water oxidation, nitrogen reduction, or hydrogen production in enzymes and inorganic catalysts often involve multimetallic clusters. In these systems, the reaction takes place between metals or metals and ligands to facilitate charge transfer, bond formation/breaking, substrate binding, and release of products. In this study, we present a method to detect X-ray emission signals from multiple elements simultaneously, which allows for the study of charge transfer and the sequential chemistry occurring between elements. Kβ X-ray emission spectroscopy (XES) probes charge and spin states of metals as well as their ligand environment. A wavelength-dispersive spectrometer based on the von Hamos geometry was used to disperse Kβ signals of multiple elements onto a position detector, enabling an XES spectrum to be measured in a single-shot mode. This overcomes the scanning needs of the scanning spectrometers, providing data free from temporal and normalization errors and therefore ideal to follow sequential chemistry at multiple sites. We have applied this method to study MnOx-based bifunctional electrocatalysts for the oxygen evolution reaction (OER) and the oxygen reduction reaction (ORR). In particular, we investigated the effects of adding a secondary element, Ni, to form MnNiOx and its impact on the chemical states and catalytic activity, by tracking the redox characteristics of each element upon sweeping the electrode potential. The detection scheme we describe here is general and can be applied to time-resolved studies of materials consisting of multiple elements, to follow the dynamics of catalytic and electron transfer reactions.

Gul, Sheraz↗
DOE OSTI2019

Product Detection of the CH Radical Reactions with Ammonia and Methyl-Substituted Amines

In this work, reactions of the methylidyne (CH) radical with ammonia (NH 3 ), methylamine (CH 3 NH 2 ), dimethylamine ((CH 3 ) 2 NH), and trimethylamine ((CH 3 ) 3 N) have been investigated under multiple collision conditions at 373 K and 4 Torr. The reaction products are detected by using soft photoionization coupled to orthogonal acceleration time-of-flight mass spectrometry at the Advanced Light Source (ALS) synchrotron. Kinetic traces are employed to discriminate between CH reaction products and products from secondary or slower reactions. Branching ratios for isomers produced at a given mass and formed by a single reaction are obtained by fitting the observed photoionization spectra to linear combinations of pure compound spectra. The reaction of the CH radical with ammonia is found to form mainly imine, HN$=$CH 2 , in line with an addition–elimination mechanism. The singly methyl-substituted imine is detected for the CH reactions with methylamine, dimethylamine, and trimethylamine. Dimethylimine isomers are formed by the reaction of CH with dimethylamine, while trimethylimine is formed by the CH reaction with trimethylamine. Overall, the temporal profiles of the products are not consistent with the formation of aminocarbene products in the reaction flow tube. In the case of the reactions with methylamine and dimethylamine, product formation is assigned to an addition–elimination mechanism similar to that proposed for the CH reaction with ammonia. However, this mechanism cannot explain the products detected by the reaction with trimethylamine. A C—H insertion pathway may become more probable as the number of methyl groups increases.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2024

Interpretations of the ATLAS measurements of Higgs boson production and decay rates and differential cross-sections in pp collisions at $\sqrt{s}$ = 13 TeV

Measurements of the Higgs boson production times decay rates and differential cross-sections have recently been performed by the ATLAS experiment in several decay channels using up to 139 fb -1 of proton-proton collision data at $\sqrt{s}$ = 13 TeV recorded at the Large Hadron Collider. This paper presents multiple interpretations of these Higgs boson measurements. Measurements of production-mode cross-sections, simplified template cross-sections and fiducial differential cross-sections in different decay channels are reparameterised in terms of the impact of Standard Model effective field theory operators, and constraints are reported on the corresponding Wilson coefficients. Production and decay rate measurements are interpreted in UV-complete extensions of the Standard Model, namely the two-Higgs-doublet model (2HDM) near the alignment limit and the Minimal Supersymmetric Standard Model (MSSM) for various MSSM benchmark scenarios. The constraints on the 2HDM parameters (cos(β - α), tanβ) and the MSSM parameters (m A , tanβ) are complementary to those obtained from direct searches for additional Higgs bosons.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2023

Deciphering the evolution of flavin-dependent monooxygenase stereoselectivity using ancestral sequence reconstruction

Controlling the selectivity of a reaction is critical for target-oriented synthesis. Accessing complementary selectivity profiles enables divergent synthetic strategies, but is challenging to achieve in biocatalytic reactions given enzymes’ innate preferences of a single selectivity. Thus, it is critical to understand the structural features that control selectivity in biocatalytic reactions to achieve tunable selectivity. Here, we investigate the structural features that control the stereoselectivity in an oxidative dearomatization reaction that is key to making azaphilone natural products. Crystal structures of enantiocomplementary biocatalysts guided the development of multiple hypotheses centered on the structural features that control the stereochemical outcome of the reaction; however, in many cases, direct substitutions of active site residues in natural proteins led to inactive enzymes. Ancestral sequence reconstruction (ASR) and resurrection were employed as an alternative strategy to probe the impact of each residue on the stereochemical outcome of the dearomatization reaction. These studies suggest that two mechanisms are active in controlling the stereochemical outcome of the oxidative dearomatization reaction: one involving multiple active site residues in AzaH and the other dominated by a single Phe to Tyr switch in TropB and AfoD. Moreover, this study suggests that the flavin-dependent monooxygenases (FDMOs) adopt simple and flexible strategies to control stereoselectivity, which has led to stereocomplementary azaphilone natural products produced by fungi. This paradigm of combining ASR and resurrection with mutational and computational studies showcases sets of tools for understanding enzyme mechanisms and provides a solid foundation for future protein engineering efforts.

Science & Technology - Other Topics↗
DOE OSTI2021

Productive Programming of Distributed Systems with the SHAD C++ Library

High-performance computing (HPC) is often perceived as a matter of making large-scale systems (e.g., clusters) run as fast as possible, regardless the required programming effort. However, the idea of "bringing HPC to the masses" has recently emerged. Inspired by this vision, we have designed SHAD, the Scalable High-performance Algorithms and Data-structures library. SHAD is open source software, written in C++, for C++ developers. Unlike other HPC libraries for distributed systems, which rely on SPMD models, SHAD adopts a shared-memory programming abstraction, to make C++ programmers feel at home. Underneath, SHAD manages tasking and data-movements, moving the computation where data resides and taking advantage of asynchrony to tolerate network latency. At the bottom of his stack, SHAD can interface with multiple runtime systems: this not only improves developer’s productivity, by hiding the complexity of such software and of the underlying hardware, but also greatly enhance code portability. Thanks to its abstraction layers, SHAD can indeed target different systems, ranging from laptops to HPC clusters, without any need for modifying the user-level code. We have prototyped and open-sourced the implementation of (a subset of) the C++ standard library (STL) targeting multi-node HPC clusters. Our work allows plain STL-based C++ code to scale on HPC systems, with no need for rewriting the code to exploit the complex hardware. SHAD is available under Apache v2 License at https://github.com/pnnl/SHAD. In this paper we overview the design of the SHAD library, depicting its main components: runtime systems abstractions for tasking; parallel and distributed data-structures; STL-compliant interfaces and algorithms.

Castellana, Vito G.↗
NASA NTRSDate not supplied

Using Polarized PCRTM-Solar Model to Validate EMIT Surface Reflectance L2A Product

Using the vector linearized discrete ordinate radiative transfer model (VLIDORT), a multiple-scattering multi-layer scattering code, coupled with a fast principal component (PC) radiative transfer model (PCRTM), we can simulate hyperspectral radiation fields from visible to shortwave infrared (VSWIR), i.e., 250 nm to 2500 nm. Since only limited accurate line-by-line calculation using VLIDORT is needed, this coupled PCRTM-VLIDORT approach is very efficient for simulating hyperspectral VSWIR spectra. These simulations incorporate accurately defined optical properties (gas absorptions, molecular and aerosol/cloud particle scattering) and detailed surface reflectance inputs. In this study we used the current L2A products of the Earth Surface Mineral Dust Source Investigation (EMIT) imaging spectrometer as the inputs to PCRTM-VLIDORT to simulate EMIT spectra. Comparing the simulated spectra with EMIT measurements provides an efficient method to validate the current EMIT product.

Xiaozhen Xiong↗
DOE OSTI2017

Measurement of jet activity produced in top-quark events with an electron, a muon and two b -tagged jets in the final state in pp collisions at √s = 13 TeV with the ATLAS detector

Measurements of jet activity in top-quark pair events produced in proton–proton collisions are presented, using 3.2 fb –1 of pp collision data at a centre-of-mass energy of 13 TeV collected by the ATLAS experiment at the Large Hadron Collider. Events are chosen by requiring an opposite-charge eμ pair and two b-tagged jets in the final state. The normalised differential cross-sections of top-quark pair production are presented as functions of additional-jet multiplicity and transverse momentum, p T . The fraction of signal events that do not contain additional jet activity in a given rapidity region, the gap fraction, is measured as a function of the p T threshold for additional jets, and is also presented for different invariant mass regions of the eμbb¯ system. All measurements are corrected for detector effects and presented as particle-level distributions compared to predictions with different theoretical approaches for QCD radiation. While the kinematics of the jets from top-quark decays are described well, the generators show differing levels of agreement with the measurements of observables that depend on the production of additional jets.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2018

Geodetic measurements and numerical models of transient deformation at Raft River geothermal field, Idaho, USA

Here, we perform synthetic aperture radar interferometry using data acquired between 2004 and 2016 by the Envisat, and ALOS-2 satellite missions to measure transient deformation at the Raft River geothermal field in Cassia County in Southern Idaho where geothermal production began in late 2007. Time-series analysis of multiple interferometric pairs indicates uplift at an exponentially decaying rate, over an ~8 km-by-5 km area centered near three injection wells that recycle produced brine. Similarly, subsidence at an exponentially decaying rate is observed in a 4 km-by-4 km area west of the production wells. These two signatures stay in the same location in all of the well-correlated Envisat interferometric pairs spanning the time interval between 2007 and 2010. The boundary separating the uplifting and subsiding areas is associated with the steeply dipping Bridge fault zone. Using two-dimensional numerical models, we explore first-order, bi-directional coupling between hydrological and mechanical processes. Our results suggest that: (i) most of the deformation occurs due to pore pressure changes following the start of geothermal production, (ii) the rate of deformation decays to zero over a time scale on the order of ~5 years as the system reaches steady state, and (iii) a reservoir-scale permeability of the order of ~1E–14 m 2 is required to explain the transient deformation.

15 GEOTHERMAL ENERGY↗
DOE OSTI2019

Agrivoltaics provide mutual benefits across the food–energy–water nexus in drylands

The vulnerabilities of our food, energy and water systems to projected climatic change make building resilience in renewable energy and food production a fundamental challenge. We investigate a novel approach to solve this problem by creating a hybrid of colocated agriculture and solar photovoltaic (PV) infrastructure. We take an integrative approach - monitoring microclimatic conditions, PV panel temperature, soil moisture and irrigation water use, plant ecophysiological function and plant biomass production within this 'agrivoltaics' ecosystem and in traditional PV installations and agricultural settings to quantify trade-offs. We find that shading by the PV panels provides multiple additive and synergistic benefits, including reduced plant drought stress, greater food production and reduced PV panel heat stress. The results presented here provide a foundation and motivation for future explorations towards the resilience of food and energy systems under the future projected increased environmental stress involving heat and drought.

14 SOLAR ENERGY↗
DOE OSTI2023

Designing Iowa Agricultural Landscapes to Improve Environmental Co-Benefits of Bioenergy Production

Cellulosic bioenergy feedstocks are needed to improve carbon (C) management while provisioning biomass for bioproducts and biofuel. The transition to increased cellulosic biomass production can be guided by land management plans designed to improve economic, environmental, and ecological performance. We constructed a sustainability model to compare landscape designs for biofuel production from corn (Zea mays L.) stover and switchgrass (Panicum virgatum L.) in central Iowa, USA. We used the model to compare environmental and socioeconomic outcomes associated with four landscape management strategies, with and without cellulosic biomass markets. We evaluated (1) a fuelshed area containing over 1.2 million ha (3 million acres) of corn and soybean (Glycine max (L.) Merr.) within 80 km (50 miles) of a commercial-scale cellulosic biorefinery in Nevada, Iowa, and (2) the South Fork watershed containing over 72,000 ha (178,000 acres) of these row crops within eight north central Iowa HUC-12 (hydrologic unit code) watersheds. At both landscape scales, we found that it is possible to achieve multiple environmental and socioeconomic benefits concomitantly with cellulosic biomass production by strategically collecting corn stover and converting the 10% of the lowest-profitability row crop land to perennial switchgrass. Potential benefits from landscape design include increased biodiversity, soil and water quality improvements, increased soil carbon sequestration for climate change mitigation, and reduced fertilizer use and cost. Our model results showed that increasing benefits can accrue when complementary conservation practices (e.g., reduced tillage, use of a rye cover crop) are combined and integrated throughout a fuelshed or watershed area. We conclude that ecologically based landscape designs offer valuable insights about costs and benefits of land management alternatives, with relevance for achieving stakeholder goals.

54 ENVIRONMENTAL SCIENCES↗
DOE OSTI2016

Kinetic Analysis of Competitive Electrocatalytic Pathways: New Insights into Hydrogen Production with Nickel Electrocatalysts

The hydrogen production electrocatalyst Ni(PPh2NPh2)22+ (1) is capable of traversing multiple electrocatalytic pathways. When using dimethylformamidium, DMF(H)+, the mechanism of formation of H2 catalyzed by 1 changes from an ECEC to an EECC mechanism as the potential approaches the Ni(I/0) couple. Two recent electrochemical methods, current-potential analysis and foot-of-the-wave analysis (FOWA), were performed on 1 to measure the detailed chemical kinetics of the competing ECEC and EECC pathways. A sensitivity analysis was performed on the electrochemical methods using digital simulations to gain a better understanding of their strengths and limitations. Notably, chemical rate constants were significantly underestimated when not accounting for electron transfer kinetics, even when electron transfer was fast enough to afford a reversible non-catalytic wave. The EECC pathway of 1 was found to be faster than the ECEC pathway under all conditions studied. Using buffered DMF: DMF(H)+ mixtures led to an increase in the catalytic rate constant (kobs) of the EECC pathway, but kobs for the ECEC pathway did not change when using buffered acid. Further kinetic analysis of the ECEC path revealed that added base increases the rate of isomerization of the exo-protonated Ni(0) isomers to the catalytically active endo-isomers, but decreases the net rate of protonation of Ni(I). FOWA on 1 did not provide accurate rate constants due to incomplete reduction of the exo-protonated Ni(I) intermediate at the foot of the wave, but FOWA could be used to estimate the reduction potential of this previously undetected intermediate. This research was supported as part of the Center for Molecular Electrocatalysis, an Energy Frontier Research Center funded by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences. Pacific Northwest National Laboratory is operated by Battelle for the U.S. Department of Energy.

electrocatalysis↗
NASA NTRS2010

Liquid Oxygen Propellant Densification Production and Performance Test Results With a Large-Scale Flight-Weight Propellant Tank for the X33 RLV

This paper describes in-detail a test program that was initiated at the Glenn Research Center (GRC) involving the cryogenic densification of liquid oxygen (LO2). A large scale LO2 propellant densification system rated for 200 gpm and sized for the X-33 LO2 propellant tank, was designed, fabricated and tested at the GRC. Multiple objectives of the test program included validation of LO2 production unit hardware and characterization of densifier performance at design and transient conditions. First, performance data is presented for an initial series of LO2 densifier screening and check-out tests using densified liquid nitrogen. The second series of tests show performance data collected during LO2 densifier test operations with liquid oxygen as the densified product fluid. An overview of LO2 X-33 tanking operations and load tests with the 20,000 gallon Structural Test Article (STA) are described. Tank loading testing and the thermal stratification that occurs inside of a flight-weight launch vehicle propellant tank were investigated. These operations involved a closed-loop recirculation process of LO2 flow through the densifier and then back into the STA. Finally, in excess of 200,000 gallons of densified LO2 at 120 oR was produced with the propellant densification unit during the demonstration program, an achievement that s never been done before in the realm of large-scale cryogenic tests.

Tomsik, Thomas M.↗
DOE OSTI2020

A Multi-Instrument Cloud Condensation Nuclei Spectrum Product (Final Technical Report)

A wealth of observational data exists on the characteristics of atmospheric particulate matter, over multiple years, at the DOE ARM Southern Great Plains (SGP) Central Facility site. This site is located in a region of the country that frequently experiences weather extremes, and that is removed from many local sources of pollution but is affected by transported smoke, dust, and urban emissions. The relationships between particulate matter, cloud formation and evolution, and precipitation are therefore of strong interest, and are being explored via modeling on a variety of scales. These models require as input detailed information on the characteristics of particles capable of serving as the nuclei for cloud formation. Sufficient data exist to be able to put together a picture of the nature of the total aerosol and the cloud condensation nuclei (CCN) subset, and their variability, through merged data products. This study was aimed at exploiting the multiple measurement types at SGP to develop the first such multi-year estimates. Further, the resulting data were analyzed to understand temporal patterns ranging from hourly to seasonal, thereby gaining insights into the particle sources affecting the atmosphere in this region. DOE-funded datasets that were analyzed in this study include total particle number concentrations, submicron aerosol scattering coefficients, dry aerosol size distributions, and more recently, time-resolved submicron aerosol chemical composition. Data are also available for the number concentrations of particles that are activated in a cloud condensation nucleus instrument at a series of setpoint supersaturations, providing direct observations of the number concentrations of “CCN”. This variable is the quantity that is generally desired for inclusion in numerical models that seek to represent and predict the impacts of varying aerosol characteristics on the formation and microphysical properties of clouds. One limitation of the use of direct CCN observations is that they are not available for supersaturations larger than about 1%, which is insufficient for deep convection and may be insufficient even for shallow convection, depending on the nature of the available CCN and the dynamics of the cloud. We developed a data-based approach to representing the full aerosol size spectrum with size-dependent hygroscopicity, and used this to extrapolate CCN spectra beyond the limited measurements. Five years of SGP aerosol data (2009 -2013) were analyzed. As a side product of our work, we identified and communicated several previously-unflagged data quality issues. The resulting merged aerosol distributions, along with fits for seasonal averages, were published and submitted to the ARM archive as a special value-added product (VAP; submitted as a PI product). CCN spectra were computed for the same data period and will similarly be published and submitted to the archive for use by the community. We also note that our methodologies and findings have been discussed at several Joint ARM User Facility/Atmospheric System Research (ASR) Principal Investigators Meetings and that recent ARM/ASR aerosol data reporting strategies have included similar ideas for data merging, indicating that this work has had a lasting impact on ARM aerosol data acquisition and reporting. The proposed work advances the science of the interactions of aerosols, clouds and precipitation, with direct application to improve representation of such interactions for clouds in regional and global climate models. The archived data will continue to serve research studies in the future.

54 ENVIRONMENTAL SCIENCES↗