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At least 1,441 records · Page 80

External Dependencies-Driven Architecture Discovery and Analysis of Implemented Systems

A method for architecture discovery and analysis of implemented systems (AIS) is disclosed. The premise of the method is that architecture decisions are inspired and influenced by the external entities that the software system makes use of. Examples of such external entities are COTS components, frameworks, and ultimately even the programming language itself and its libraries. Traces of these architecture decisions can thus be found in the implemented software and is manifested in the way software systems use such external entities. While this fact is often ignored in contemporary reverse engineering methods, the AIS method actively leverages and makes use of the dependencies to external entities as a starting point for the architecture discovery. The AIS method is demonstrated using the NASA's Space Network Access System (SNAS). The results show that, with abundant evidence, the method offers reusable and repeatable guidelines for discovering the architecture and locating potential risks (e.g. low testability, decreased performance) that are hidden deep in the implementation. The analysis is conducted by using external dependencies to identify, classify and review a minimal set of key source code files. Given the benefits of analyzing external dependencies as a way to discover architectures, it is argued that external dependencies deserve to be treated as first-class citizens during reverse engineering. The current structure of a knowledge base of external entities and analysis questions with strategies for getting answers is also discussed.

Ganesan, Dharmalingam↗

Managing and Servicing Physical Oceanographic Data at a NASA Distributed Active Archive Center

The NASA Earth Science Data Information Systems Project funds and operates 12 Distributed Active Archive Center(s) (DAAC) throughout the United States. Of these 12 centers, the Physical Oceanography DAAC (PO.DAAC) is committed to providing long term archival, distribution and stewardship for NASA physical oceanographic data, primarily derived from space-born satellite systems, but also including a growing set of recent and future in situ observations from the SPURS-1 and SPURS-2 campaigns. Notable NASA missions supported include: Seasat, TOPEX/Poseidon, NSCAT, QuikSCAT, ISS-RapidScat, Jason-1, Jason-2/OSTM, GRACE, Aquarius, GHRSST, and MODIS. The following interagency and international missions are also supported by PO.DAAC: AVHRR, Coriolis, DMSP, MetOp-A, MetOp-B, Oceansat-2. The PO.DAAC currently holds 525 datasets in public distribution, spanning the following observational parameters: sea surface temperature, sea surface salinity, ocean color, ocean surface currents, ocean surface wind speed, ocean surface wind direction, sea surface height, significant wave height, ocean water mass/thickness, and sea ice age. A hundred of these datasets are available in near-real-time. Datasets are distributed through a variety of open-source access protocols including FTP, OPeNDAP, and THREDDS. FTP will soon be phased out in favor of a recently introduced HTTPS PO.DAAC Drive interface that supports WebDAV and interoperable machine-to-machine communication. OPeNDAP supports remote data/metadata query, subset, and download. THREDDS provides the features of OPeNDAP with the additional feature of temporal aggregation. PO.DAAC also offers proprietary tools and services to further enhance the data discovery, visualization and analysis experience, including but not limited to: State of the Ocean, Web Services (data/metadata discovery and extraction), HiTIDE Level-2 subsetter, Live Access Server (LAS), Webification (w10nsci), and Rich Site Summary (RSS) Datacasting. To assist with provenance of datasets, PO.DAAC has implemented DOIs for the data it distributes so that they can be properly cited. There is a user forum and helpdesk that contains data recipes and via which users can get guidance. In summary, this presentation aims to provide a general overview of PO.DAAC’s web portal and data holdings along with a set of illustrative examples leading prospective data users into the practical utility of its tools and services.

Moroni, David F.↗

Spectroscopic Mass and Host-star Metallicity Measurements for Newly Discovered Microlensing Planet OGLE-2018-BLG-0740Lb

We report the discovery of the microlensing planet OGLE-2018-BLG-0740Lb. The planet is detected with a very strong signal of Δχ(exp 2) ∼ 4630, but the interpretation of the signal suffers from two types of degeneracies. One type is caused by the previously known close/wide degeneracy, and the other is caused by an ambiguity between two solutions, in which one solution requires the incorporation of finite-source effects, while the other solution is consistent with a point-source interpretation. Although difficult to be firmly resolved based on only the photometric data, the degeneracy is resolved in strong favor of the point-source solution with the additional external information obtained from astrometric and spectroscopic observations. The small astrometric offset between the source and baseline object supports that the blend is the lens and this interpretation is further secured by the consistency of the spectroscopic distance estimate of the blend with the lensing parameters of the point-source solution. The estimated mass of the host is 1.0 ± 0.1 M(ʘ) and the mass of the planet is 4.5 ± 0.6 M(J) (close solution) or 4.8 ± 0.6 M(J) (wide solution) and the lens is located at a distance of 3.2 ± 0.5 kpc. The bright nature of the lens, with I ∼ 17.1 (V ∼ 18.2), combined with its dominance of the observed flux suggest that radialvelocity (RV) follow-up observations of the lens can be done using high-resolution spectrometers mounted on large telescopes, e.g., Very Large Telescope/ESPRESSO, and this can potentially not only measure the period and eccentricity of the planet but also probe for close-in planets. We estimate that the expected RV amplitude would be ~60 sin i m/s.

Cheongho Han↗

Management of multiple groundwater contaminant plumes extending beyond property boundaries at the young - Rainey STAR Center (Science, Technology, and Research Center) - 15623

The US DOE Pinellas Plant-now known as the Young - Rainey STAR Center, located in Largo, Florida-manufactured components for nuclear weapons from 1956 to 1995. During decades of operations, chlorinated solvents were released from a drum storage area and from underground piping at multiple points adjacent to and beneath a 4.5-hectare (11-acre) building. Two groundwater contaminant plumes associated with contaminant sources beneath the building have been identified, delineated, and are being monitored. During a focused delineation campaign in 2008 to better define the plume boundaries prior to municipal construction projects in the area, the plumes were determined to extend beyond the site boundaries, beneath the adjacent roadway easements, and beneath four adjacent privately owned properties. US DOE has performed a number of activities in response to the discovery of the offsite contaminant plumes, including performing a high-resolution delineation of contaminant plumes; coordinating with local municipalities to complete two linear construction projects requiring dewatering in the vicinity of the plumes; performing risk assessment, risk management, risk communication, and community relations tasks associated with the project; coordinating with state regulators to identify a risk-based corrective action regulatory approach; and coordinating with impacted property owners to develop and implement institutional controls. During the replacement of a 1.2-meter (48-inch) municipal potable water line directly over the contaminant plume area, US DOE (1) constructed infrastructure to receive and treat dewatering effluent at a rate of 20 gallons per minute around the clock for 6 weeks, and (2) conducted breathing-zone air monitoring during excavation of a 3.0-meter (10-foot) deep trench. This degree of diligence was necessary to ensure and document that no site workers were exposed to chlorinated solvent vapors during the construction process, and that a large volume of potentially contaminated groundwater was properly treated and dispositioned. US DOE also took aggressive actions to pro-actively address claims regarding loss of property value on two properties associated with the groundwater contamination, which resulted in a teaming arrangement with each party for future management of the ongoing corrective actions. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

X-Ray Diffraction on Mars: Scientific Discoveries Made by the CheMin Instrument

The Mars Science Laboratory Curiosity landed in Gale crater in August 2012 with the goal to identify and characterize habitable environments on Mars. Curiosity has been studying a series of sedimentary rocks primarily deposited in fluviolacustrine environments approximately 3.5 Ga. Minerals in the rocks and soils on Mars can help place further constraints on these ancient aqueous environments, including pH, salinity, and relative duration of liquid water. The Chemistry and Mineralogy (CheMin) X-ray diffraction and X-ray fluorescence instrument on Curiosity uses a Co X-ray source and charge-coupled device detector in transmission geometry to collect 2D Debye-Scherrer ring patterns of the less than 150 micron size fraction of drilled rock powders or scooped sediments. With an angular range of approximately 2.52deg 20 and a 20 resolution of approximately 0.3deg, mineral abundances can be quantified with a detection limit of approximately 1-2 wt. %. CheMin has returned quantitative mineral abundances from 16 mudstone, sandstone, and aeolian sand samples so far. The mineralogy of these samples is incredibly diverse, suggesting a variety of depositional and diagenetic environments and different source regions for the sediments. Results from CheMin have been essential for reconstructing the geologic history of Gale crater and addressing the question of habitability on ancient Mars.

Rampe, E. B.↗

Shared Research Facilities: A Key Source of U.S. Scientific and Industrial Leadership

By the 1970s, it had become clear that X-ray and neutron beams could provide insights into the structure and properties of materials that were not obtainable in any other way. It was also clear that the cost and scale of the facilities required to produce such beams were beyond the reach of individual scientists or even major universities. So forty years ago, the Basic Energy Sciences (BES) office of DOE began to build dedicated facilities that could be used—shared—by many researchers. The result has been spectacular discoveries and insights into materials important for all forms of energy production and for national security, as well as insights into complex biological molecules and new drugs important for human health.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

FIRST DETECTION OF ULTRAVIOLET EMISSION FROM A DETACHED DUST SHELL: GALAXY EVOLUTION EXPLORER OBSERVATIONS OF THE CARBON ASYMPTOTIC GIANT BRANCH STAR U Hya

We present the discovery of an extended ring of ultraviolet (UV) emission surrounding the asymptotic giant branch (AGB) star U Hya in archival observations performed by the Galaxy Evolution Explorer. This is the third discovery of extended UV emission from a carbon AGB star and the first from an AGB star with a detached shell. From imaging and photometric analysis of the FUV and NUV images, we determined that the UV ring has a radius of ∼110'', thus indicating that the emitting material is likely associated with the detached shell seen in the infrared. We find that scattering of the central point source of NUV and FUV emission by the dust shell is negligible. Moreover, we find that scattering of the interstellar radiation field by the dust shell can contribute at most ∼10% of the FUV flux. Morphological and photometric evidence suggests that shocks caused by the star's motion through space and, possibly, shock-excited H{sub 2} molecules are the most likely origins of the UV flux. In contrast to previous examples of extended UV emission from AGB stars, the extended UV emission from U Hya does not show a bow-shock-like structure, which is consistent with a lower space velocity and lower interstellar medium density. This suggests the detached dust shell is the source of the UV-emitting material and can be used to better understand the formation of detached shells.

79 ASTRONOMY AND ASTROPHYSICS↗

Gravitational Lenses in UNIONS and Euclid (GLUE). I. A Search for Strong Gravitational Lenses in UNIONS with Subaru, CFHT, and Pan-STARRS Data

We present the results of our pipeline for discovering strong gravitational lenses in the ongoing Ultraviolet Near-Infrared Optical Northern Survey (UNIONS). We successfully train a deep residual convolutional neural network based on CMU-Deeplens architecture, which is designed to detect strong lenses in ground-based imaging surveys. We train on images of real strong lenses and deploy on a sample of 8 million galaxies in areas with full coverage in the g, r, and i filters—the first multiband search for strong gravitational lenses in UNIONS. Following human inspection and grading, we report the discovery of a total of 1346 new strong-lens candidates, of which 146 are Grade A, 199 are Grade B, and 1001 are Grade C. Of these candidates, 283 have lens galaxy spectroscopic redshifts from the Sloan Digital Sky Survey, and an additional 297 have them from the Dark Energy Spectroscopic Instrument Data Release 1. We find 15 of these systems display evidence of both lens and source galaxy redshifts in spectral superposition. We also report the spectroscopic confirmation of seven lensed sources in high-quality systems, all with z > 2.1, using the Keck Near Infrared Echellette Spectrograph and the Gemini Near-Infrared Spectrograph.

Storfer, Christopher J. [University of Hawaii, Hon↗

Outburst of the 2 s Anomalous X-ray Pulsar 1E 1547.0-5408

Following our discovery of radio pulsations from the newly recognized anomalous X-ray pulsar (AXP) 1E 1547.0-5408, we initiated X-ray monitoring with the Swift X-ray telescope and obtained a single target-of-opportunity observation with the Newton X-ray Multi-Mirror Mission (XMM-Newton). In comparison with its historic minimum flux of 3 x 10(exp -l3)ergs/sq cm/s, the source was found to be in a record high state, f(sub x)(1-8 keV) = 5 x 10(exp -12)ergs/sq cm/s, or L(sub x) = 1.7 x 10(exp 35)(d/9 kpc )(sup 2)ergs/s, and declining by 25% in 1 month. Extrapolating the decay, we bound the total energy in this outburst to 1042 ergs < E < ergs. The spectra (fitted with a Comptonized blackbody) show that an increase in the temperature and area of a hot region, to 0.5 keV and -16% of the surface area of the neutron star, respectively, are primarily responsible for its increase in luminosity. The energy, spectrum, and timescale of decay are consistent with a deep crustal heating event, similar to an interpretation of the X-ray turn-on of the transient AXP XTE J18 10- 197. Simultaneous with the 4.6 hr ATdA4-Newton observation, we observed at 6.4 GHz with the Parkes telescope, measuring the phase relationship of the radio and X-ray pulse. The X-ray pulsed fraction of 1E 1547.0-5408 is only approx. 7 %, while its radio pulse is relatively broad for such a slow pulsar, which may indicate a nearly aligned rotator. As also inferred from the transient behavior of XTE J18 10-197, the only other AXP known to emit in the radio, the magnetic field rearrangement responsible for this X-ray outburst of 1E 1547.0-5408 is probably the cause of its radio turn-on.

Halpern, J. P.↗

Scientific Opportunities with the Long-Baseline Neutrino Experiment

In this document, we describe the wealth of science opportunities and capabilities of LBNE, the Long-Baseline Neutrino Experiment. LBNE has been developed to provide a unique and compelling program for the exploration of key questions at the forefront of particle physics. Chief among the discovery opportunities are observation of CP symmetry violation in neutrino mixing, resolution of the neutrino mass hierarchy, determination of maximal or near-maximal mixing in neutrinos, searches for nucleon decay signatures, and detailed studies of neutrino bursts from galactic supernovae. To fulfill these and other goals as a world-class facility, LBNE is conceived around four central components: (1) a new, intense wide-band neutrino source at Fermilab, (2) a fine-grained `near' neutrino detector just downstream of the source, (3) the Sanford Underground Research Facility (SURF) in Lead, South Dakota at an optimal distance (~1300 km) from the neutrino source, and (4) a massive liquid argon time-projection chamber (LArTPC) deployed there as a 'far' detector. The facilities envisioned are expected to enable many other science opportunities due to the high event rates and excellent detector resolution from beam neutrinos in the near detector and atmospheric neutrinos in the far detector. This is a mature, well developed, world class experiment whose relevance, importance, and probability of unearthing critical and exciting physics has increased with time.

Adams, C.↗

Automated genome mining of ribosomal peptide natural products

Ribosomally synthesized and posttranslationally modified peptides (RiPPs), especially from microbial sources, are a large group of bioactive natural products that are a promising source of new (bio)chemistry and bioactivity (1). In light of exponentially increasing microbial genome databases and improved mass spectrometry (MS)-based metabolomic platforms, there is a need for computational tools that connect natural product genotypes predicted from microbial genome sequences with their corresponding chemotypes from metabolomic datasets. Here, we introduce RiPPquest, a tandem mass spectrometry database search tool for identification of microbial RiPPs and apply it for lanthipeptide discovery. RiPPquest uses genomics to limit search space to the vicinity of RiPP biosynthetic genes and proteomics to analyze extensive peptide modifications and compute p-values of peptide-spectrum matches (PSMs). We highlight RiPPquest by connection of multiple RiPPs from extracts of Streptomyces to their gene clusters and by the discovery of a new class III lanthipeptide, informatipeptin, from Streptomyces viridochromogenes DSM 40736 as the first natural product to be identified in an automated fashion by genome mining. The presented tool is available at cy-clo.ucsd.edu.

Environmental Molecular Sciences Laboratory↗

Regularized machine learning on molecular graph model explains systematic error in DFT enthalpies

Abstract A major goal of materials research is the discovery of novel and efficient heterogeneous catalysts for various chemical processes. In such studies, the candidate catalyst material is modeled using tens to thousands of chemical species and elementary reactions. Density Functional Theory (DFT) is widely used to calculate the thermochemistry of these species which might be surface species or gas-phase molecules. The use of an approximate exchange correlation functional in the DFT framework introduces an important source of error in such models. This is especially true in the calculation of gas phase molecules whose thermochemistry is calculated using the same planewave basis set as the rest of the surface mechanism. Unfortunately, the nature and magnitude of these errors is unknown for most practical molecules. Here, we investigate the error in the enthalpy of formation for 1676 gaseous species using two different DFT levels of theory and the ‘ground truth values’ obtained from the NIST database. We featurize molecules using graph theory. We use a regularized algorithm to discover a sparse model of the error and identify important molecular fragments that drive this error. The model is robust to rigorous statistical tests and is used to correct DFT thermochemistry, achieving more than an order of magnitude improvement.

36 MATERIALS SCIENCE↗

THE MILKY WAY PROJECT: A STATISTICAL STUDY OF MASSIVE STAR FORMATION ASSOCIATED WITH INFRARED BUBBLES

The Milky Way Project citizen science initiative recently increased the number of known infrared bubbles in the inner Galactic plane by an order of magnitude compared to previous studies. We present a detailed statistical analysis of this data set with the Red MSX Source (RMS) catalog of massive young stellar sources to investigate the association of these bubbles with massive star formation. We particularly address the question of massive triggered star formation near infrared bubbles. We find a strong positional correlation of massive young stellar objects (MYSOs) and H II regions with Milky Way Project bubbles at separations of <2 bubble radii. As bubble sizes increase, a statistically significant overdensity of massive young sources emerges in the region of the bubble rims, possibly indicating the occurrence of triggered star formation. Based on numbers of bubble-associated RMS sources, we find that 67% {+-} 3% of MYSOs and (ultra-)compact H II regions appear to be associated with a bubble. We estimate that approximately 22% {+-} 2% of massive young stars may have formed as a result of feedback from expanding H II regions. Using MYSO-bubble correlations, we serendipitously recovered the location of the recently discovered massive cluster Mercer 81, suggesting the potential of such analyses for discovery of heavily extincted distant clusters.

79 ASTRONOMY AND ASTROPHYSICS↗

INTERACTION BETWEEN THE BROAD-LINED TYPE Ic SUPERNOVA 2012ap AND CARRIERS OF DIFFUSE INTERSTELLAR BANDS

Diffuse interstellar bands (DIBs) are absorption features observed in optical and near-infrared spectra that are thought to be associated with carbon-rich polyatomic molecules in interstellar gas. However, because the central wavelengths of these bands do not correspond to electronic transitions of any known atomic or molecular species, their nature has remained uncertain since their discovery almost a century ago. Here we report on unusually strong DIBs in optical spectra of the broad-lined Type Ic supernova SN 2012ap that exhibit changes in equivalent width over short (≲ 30 days) timescales. The 4428 Å and 6283 Å DIB features get weaker with time, whereas the 5780 Å feature shows a marginal increase. These nonuniform changes suggest that the supernova is interacting with a nearby source of DIBs and that the DIB carriers possess high ionization potentials, such as small cations or charged fullerenes. We conclude that moderate-resolution spectra of supernovae with DIB absorptions obtained within weeks of outburst could reveal unique information about the mass-loss environment of their progenitor systems and provide new constraints on the properties of DIB carriers.

79 ASTRONOMY AND ASTROPHYSICS↗

SetGo: Metadata Readiness for Scientific AI Datasets

Scientific datasets intended for AI use require both computational readiness for model training and metadata readiness for discovery, sharing, and reuse. The Readiness Engine for Data Integration (REDI) addresses computational readiness, but no corresponding tool evaluates whether a dataset’s metadata are sufficiently complete, governed, and standards-compliant for publication and agent-based consumption. Existing FAIR assessors operate only on published repository records, and no single system covers FAIR compliance, licensing, provenance, governance, reproducibility, and catalog readiness together. We present SetGo, an open-source Python toolkit that assesses and repairs metadata readiness across these six dimensions before a dataset is published or archived. Applied to four scientific corpora, SetGo surfaces deficiencies that general-purpose tools do not detect: ERA5 climate metadata scores 4% on ACDD 1.3 compliance; materials datasets fail OPTIMADE species-definition requirements; and PDB-derived proteomics data carries licensing terms incompatible with standard SPDX identifiers. Guided enrichment raises overall FAIR scores from 52–57% to 81–91%, and a single setgo publish command pushes to Hugging Face Hub, CKAN, or OpenMetadata with ML Commons Croissant 1.0 metadata sidecars. To support interactive and automated workflows, SetGo integrates with coding agents powered by large language models (LLMs) through a /setgo skill that enables natural-language execution of the full assess–enrich–publish loop, with user involvement limited to supplying missing metadata values.

Wilkinson, Sean [ORNL] (ORCID:0000000214437479)↗

Production of Cf-252 and other transplutonium isotopes at Oak Ridge National Laboratory

In 1957 Glenn T. Seaborg conceived and advocated for the construction of the High Flux Isotope Reactor (HFIR) and the Transuranium Processing Plant (since then renamed the Radiochemical Engineering Development Center, or REDC) at Oak Ridge National Laboratory. There, heavily shielded hot cells, glove boxes, and laboratories allow recovery of transuranium elements produced in substantial quantities. Seaborg’s vision of HFIR and REDC producing milligram quantities of berkelium, californium, and einsteinium has been fulfilled beginning in 1966 through May 2019 with 78 production campaigns yielding a cumulative totals of 1.2 g of 249 Bk, 10.2 g of 252 Cf, 39 mg of 253 Es, and 15 pg of 257 Fm. Notably, 252 Cf is a neutron source used in many industrial applications including oil exploration; process control systems for the cement industry, coal analysis, and power production; sources to start nuclear reactors and perform nondestructive materials analyses; homeland security and national defense detection devices; and medical research. Isotopes made available through transplutonium production at HFIR/REDC have enabled scientists to study the nuclear properties and reactions, chemical properties, optical properties, and solid-state properties of transplutonium elements. Long-lived isotopes have served as targets in heavy ion accelerators to produce heavier elements leading to the discovery of 104 Rf, 105 Db, 106 Sg, 113 Nh, 114 Fl, 115 Mc, 116 Lv, 117 Ts, and 118 Og. This paper reviews the evolution of the processing flowsheets to produce, separate, and purify transplutonium isotopes, which have evolved over 50 years of operation at HFIR and REDC, and summarizes directions of future work to improve the efficiency of the production operations.

38 RADIATION CHEMISTRY, RADIOCHEMISTRY, AND NUCLEA↗

Exploring Milkyway Halo Substructures with Large-Area Sky Surveys

Over the last two decades, our understanding of the Milky Way has been improved thanks to large data sets arising from large-area digital sky surveys. The stellar halo is now known to be inhabited by a variety of spatial and kinematic stellar substructures, including stellar streams and stellar clouds, all of which are predicted by hierarchical Lambda Cold Dark Matter models of galaxy formation. In this dissertation, we first present the analysis of spectroscopic observations of individual stars from the two candidate structures discovered using an M-giant catalog from the Two Micron All-Sky Survey. The follow-up observations show that one of the candidates is a genuine structure which might be associated with the Galactic Anticenter Stellar Structure, while the other one is a false detection due to the systematic photometric errors in the survey or dust extinction in low Galactic latitudes. We then presented the discovery of an excess of main sequence turn-off stars in the direction of the constellations of Eridanus and Phoenix from the first-year data of the Dark Energy Survey (DES) – a five-year, 5,000 deg2 optical imaging survey in the Southern Hemisphere. The Eridanus-Phoenix (EriPhe) overdensity is centered around l ~ 285° and b ~ -60° and the Poisson significance of the detection is at least 9σ. The EriPhe overdensity has a cloud-like morphology and the extent is at least ~ 4 kpc by ~ 3 kpc in projection, with a heliocentric distance of about d ~ 16 kpc. The EriPhe overdensity is morphologically similar to the previously-discovered Virgo overdensity and Hercules-Aquila cloud. These three overdensities lie along a polar plane separated by ~ 120° and may share a common origin. In addition to the scientific discoveries, we also present the work to improve the photometric calibration in DES using auxiliary calibration systems, since the photometric errors can cause false detection in first the halo substructure. We present a detailed description of the two auxiliary calibration systems built at Texas A&M University. We then discuss how the auxiliary systems in DES can be used to improve the photometric calibration of the systematic chromatic errors – source color-dependent systematic errors that are caused by variations in the wavelength dependence of the atmospheric transmission and the instrumental throughput.

79 ASTRONOMY AND ASTROPHYSICS↗

Abstract for CRADA between National Energy Technology Laboratory and Mattiq, Inc.

To decarbonize the chemicals and fuels industry, we require new and innovative technologies that can leverage renewable feedstocks including renewable electricity and renewable carbon sources, such as CO 2 . State-of-the-art (SOTA) CO 2 utilization technologies that can produce renewable chemicals and fuels, such as the electrochemical reduction of CO 2 , are still significantly lacking in efficiency, and are therefore not cost-competitive with existing infrastructure. The key bottleneck to cost-competitive chemicals and fuels sourced from CO 2 and renewable electricity is the lack of any efficient catalyst material. The National Energy Technology Laboratory (NETL) and Mattiq will collaborate in the development of an efficient catalyst material that can effectively convert CO 2 into products of interest. Specifically, NETL will utilize high-performance computing to greatly reduce the number of potential materials to be investigated by Mattiq ultrahigh-throughput experimental catalyst discovery framework. This work is poised to rapidly accelerate the development of novel and efficient CO 2 reduction electrocatalysts that can bring CO 2 utilization closer to commercial viability.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗