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AGC-4 Experiment Irradiation Monitoring Data Qualification Final Report

The Graphite Technology Development Program ran a series of six experiments to quantify the effects of irradiation on nuclear grade graphite. This report focuses on the fourth experiment, Advanced Graphite Creep 4 (AGC 4). The Advanced Reactor Development (ARD) Technology Development Office (TDO) Program for research and development activities require documentation of qualified monitoring data to design and license the first high-temperature reactor nuclear plant. Qualified data meets the requirements for use as described in the experiment planning and quality assurance documents. Failed data do not meet the requirements and provide no useable information. Trend data may not meet all requirements but still provide some useable information. Use of Trend data requires assessment of how any deficiencies affect a particular use of the data. AGC-4 began with Advanced Test Reactor (ATR) Cycle 157D on May 30, 2015. After irradiating the graphite for two cycles, the capsule was removed from the reactor after ATR Cycle 158A, which ended on January 2, 2016, due to interference with another experiment. Irradiation was resumed with Cycle 162A on October 7, 2017 after the interfering experiment was removed from the reactor. AGC-4 irradiation completed by the end of Cycle 166B on January 10, 2020. Between Cycles 162A and 166B, AGC-4 capsule was removed from the reactor core during two Powered Axial Locator Mechanism (PALM) Cycles 163A and 165A to avoid overheating. All thermocouples (TCs) have functioned throughout the AGC-4 experiment. A total of 9,256,184 out of all 11,167,213 temperature records (or 82.9%) are Qualified for use by the ARD Program and 1,911,029 missing values are Failed. Argon, helium, and total gas flow data were within expected ranges, except only eight out-of-range values occurred during outages. A total of 21,240,627 out of all 22,288,5103 gas flow rates (or 92.8%) are Qualified for use by the ARD Program and 1,644,476 are Failed records mostly due to missing values. Discharge gas line moisture values were consistently low during full ATR power, except for 162B, when moisture content was increasing to more than 200 ppmv by the end of this cycle. During outages, moisture content reached as high as 700 ppmv. 1,089,941 out of a total of 1,107,331 moisture values (or 98.4%) are within the measurement range of the instrument and are Qualified for use by the ARD Program and 17,390 missing moisture values are Failed. Graphite creep specimens were subjected to one of three loads: 393, 491, or 589 lbf. For a brief period during Cycle 157D between 12:19 on June 2, 2015, and 08:23 on June 11, 2015, the load cells were wired incorrectly, resulting in missing stack load data. Missing stack loads were estimated from measured ram pressures using regression equations developed from the existing data from Cycle 157D. Estimated stack loads during this period are considered to be an accurate representation of actual load applied to the stacks. These loads deviate slightly from the planned loads. This deviation does not prevent the data from being Qualified for use but must be taken into account when analyzing the effect of load on creep. 6,095,728 out of a total of 6,403,985 moisture values (or 95.2%) are within the measurement range of the instrument and are Qualified for use by the ARD Program and 308,257 missing load values are Failed. Stack displacement increased consistently throughout the eight cycles, with total displacement reached highest value of 2.4 in by the end of irradiation. During ATR outages, a set of pneumatic rams raised the stacks of graphite creep specimens to ensure the specimens were not stuck within the test train. This stack raising was performed seven times throughout irradiation. All stacks were raised successfully each time. 4,744,974 out of a total of 6,094,513 displacement values (or 77.9%) are within the measurement range of the instrument and are Qualified for use by the ARD Program and 1,349,539 displacement values are Failed mostly due to missing values. Analyses were conducted on correlations between TCs to look for trends and step changes that might indicate instrument degradation or failure. Correlation analysis was used to identify instances when TCs form short circuits, referred to as virtual junctions, which result in TCs reporting temperatures from some location in the capsule other than the location where they were intended to read. No evidence of virtual junctions was found. Analyses were also conducted on control charts of temperature differences of between two TCs, which are expected to behave consistently throughout the entire irradiation period. Upward or downward trend over time indicates at least one TC in the pair was drifted. Examining control charts for all 66 possible pairs out of twelve TCs installed in the AGC-4 capsules reveal no clear drift failures occurred, except unstable behavior of two TCs in Zone 3, TC-7 and TC-8, over irradiation time. In conclus

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Data Validation for Earth Probe-Total Ozone Mapping Spectrometer

This presentation represents the final report for the NASA grant project. The goal of this project was to provide scientific analysis to aid in validation fo data sets used in detection of long term global trends of total ozone. Ozone data from the Earth Probe Total Ozone Mapping Spectrometer instrument was compared for validation purposes with features in previous TOMS data. Atmospheric dynamic concepts were used in the analysis. The publications sponsored by the grant are listed along with abstracts.

Stanford, John L.↗

Surface radiation trends at North Slope of Alaska influenced by large-scale circulation and atmospheric rivers

Arctic amplification manifests as a pervasive warming trend emerging over the past century in near-surface air temperature throughout the Arctic that is double the globally averaged temperature increase throughout most of the year. It results from complex processes involving oceanic, atmospheric and terrestrial components which require detailed study to discern roles of the fundamental processes involved to improve predictions of the Arctic environment. We report on signals that are beginning to emerge, on a timescale predicted by recent satellite remote sensing studies, from the unique 25 year record of detailed surface-based radiometer measurements obtained by the US Department of Energy Atmospheric Radiation Measurement (ARM) Facility North Slope of Alaska (NSA) site at Utqiaġvik, Alaska. Statistically significant warming trends are found at the site in the boreal fall, while a decrease in net radiation occurs in late summer. This decrease is driven primarily by the decrease in shortwave radiation resulting from increasing cloud liquid water path as observed by the microwave radiometer. The magnitude of the liquid water path trends is slightly larger than the root mean square error (RMSE) due to natural variability, while the magnitude of the net radiation trends is smaller than the RMSE natural variability, emphasizing that these signals are only just emerging. Analysis of prevailing meteorological regimes linking NSA with the Arctic Ocean and subarctic latitudes, and atmospheric rivers, suggests that specific changing circulation patterns are the primary driver for these summertime trends.

Lubin, Dan [Univ. of California, San Diego, CA (Un↗

Soyuz Landing Reconstructions

Introduction: Recent data show a landing-attributed injury rate among Soyuz crew members to be higher than predicted in original certification analysis. New vehicles being developed for NASA are being certified using analytical tools to quantify injury risk. This assessment will provide data to allow the Agency to evaluate whether these tools are able to capture true injury risk and allow a comparison between Soyuz landings and upcoming vehicles. Methods: A finite element model (FEM) of the Soyuz descent module (DM) and its landing environment were developed to recreate Soyuz landing conditions. Occupant breakout models composed of the Soyuz seat and Sokol helmet were then developed to evaluate occupant response. These models included both anthropomorphic test device (ATD) and human body model (HBM) surrogates in three anthropometric sizes. A generalized distribution analysis of the Soyuz landing environment was performed using landing variable distributions from available literature. Results were used to identify trends in vehicle landing acceleration with landing conditions and to compare landing model injury risk predictions with those estimated in vehicle certification analysis. Next, historic Soyuz landings identified as inducing occupant injury during were reconstructed using the developed landing model and estimated landing conditions. Results and Discussion: This assessment demonstrated the capability of certification metrics, which include a combination of vehicle- and occupant-level injury risk analysis, to identify elevated injury risk landing conditions. However, the developed landing load predictions were limited by available vehicle and landing condition data. Additional data, particularly landing acceleration data specific to historic Soyuz landing conditions, would greatly enhance this assessment’s findings.

Preston Greenhalgh↗

How New Mexico Leveraged a COVID-19 Case Forecasting Model to Preemptively Address the Healthcare Needs of the State: Quantitative Analysis

Prior to the COVID-19 pandemic, US hospitals relied on static projections of future trends for long-term planning and were only beginning to consider forecasting methods for short-term planning of staffing and other resources. With the overwhelming burden imposed by COVID-19 on the health care system, an emergent need exists to accurately forecast hospitalization needs within an actionable timeframe. Our goal was to leverage an existing COVID-19 case and death forecasting tool to generate the expected number of concurrent hospitalizations, occupied intensive care unit (ICU) beds, and in-use ventilators 1 day to 4 weeks in the future for New Mexico and each of its five health regions. We developed a probabilistic model that took as input the number of new COVID-19 cases for New Mexico from Los Alamos National Laboratory’s COVID-19 Forecasts Using Fast Evaluations and Estimation tool, and we used the model to estimate the number of new daily hospital admissions 4 weeks into the future based on current statewide hospitalization rates. The model estimated the number of new admissions that would require an ICU bed or use of a ventilator and then projected the individual lengths of hospital stays based on the resource need. By tracking the lengths of stay through time, we captured the projected simultaneous need for inpatient beds, ICU beds, and ventilators. We used a postprocessing method to adjust the forecasts based on the differences between prior forecasts and the subsequent observed data. Thus, we ensured that our forecasts could reflect a dynamically changing situation on the ground. Forecasts made between September 1 and December 9, 2020, showed variable accuracy across time, health care resource needs, and forecast horizon. Forecasts made in October, when new COVID-19 cases were steadily increasing, had an average accuracy error of 20.0%, while the error in forecasts made in September, a month with low COVID-19 activity, was 39.7%. Across health care use categories, state-level forecasts were more accurate than those at the regional level. Although the accuracy declined as the forecast was projected further into the future, the stated uncertainty of the prediction improved. Forecasts were within 5% of their stated uncertainty at the 50% and 90% prediction intervals at the 3- to 4-week forecast horizon for state-level inpatient and ICU needs. However, uncertainty intervals were too narrow for forecasts of state-level ventilator need and all regional health care resource needs. Real-time forecasting of the burden imposed by a spreading infectious disease is a crucial component of decision support during a public health emergency. Our proposed methodology demonstrated utility in providing near-term forecasts, particularly at the state level. This tool can aid other stakeholders as they face COVID-19 population impacts now and in the future.

60 APPLIED LIFE SCIENCES↗

Evaluation of ERTS-1 imagery for mapping Quaternary deposits and landforms in the Great Plains and Midwest

The author has identified the following significant results. Maps at 1:1 million scale exemplifying the first phase of the investigation (which consists of the identification and mapping of landform and land use characteristics and surficial geologic materials directly from the ERTS-1 images without use of additional data) were prepared. For areas that have not been mapped at 1:500,000 or larger scales, maps will provide the first moderately detailed information on landform features and surficial materials. Much of the information mapped is significant for exploration and development of ground (and, locally, petroleum) and for applications in engineering and environmental geology, including land use planning. Analysis of drainage patterns, stream-divide relations and land use patterns has revealed several possible moraine-controlled divices of middle and early Pleistocene age. One is an extension of the Cedar Bluffs moraine of southeastern Nebraska. Another of these divides may correspond to the terminus of Nebraska drift in the Kansas City study area. The trends of parts of various ancient filled valleys also have been identified by analysis of charges in width of the present stream valleys. The alinements of certain segments of stream valleys in Kansas and Missouri appear to be controlled by regional faults or other structural features.

Morrison, R. B.↗

Analysis of faults and pit chains in Noctis Labyrinthus: Implications for early extension and possible magmatic plumbing

Noctis Labyrinthus has been a region of disputed origin due to its complexity and poor understanding of how various processes and mechanisms may have combined to form it. The surface is an integrated record of intensive tectonic activity expressed by a multiple extended sets of dip-slip faults oriented in different directions, and thought to have acted on this region over its history. These faults are always coalescent to pits and pit chains displaying a complicated geological history in the region. To understand this geological history, we mapped the surface features in Noctis Labyrinthus using the High-Resolution Stereo Camera (HRSC) onboard Mars Express ND2 nadir channel basemaps, and we adapted the Digital Terrain Map (DTM) from the Mission Experiment Gridded Data Record (MEGDR) of Mars Orbiter Laser Altimeter (MOLA) onboard Mars Global Surveyor (MGS) for the topography. We have investigated the spatial distribution and trend of fault systems, the pit chains' morphology, and the correlation between these two types of features. Our results show three fault systems: i) NS and NNE-SSW, ii) EW and ENE-WSW, and iii) NNW-SSE and NW. The analysis of the faults trending, cross-cutting correlation and the superimposition led to identify multiple intersections between these faults that have been alongside with the reactivations of some inherited faults. We interpreted the first system of fault to be related to coeval lateral extension, generated by regional stress tensor, which is probably related to the slight bending of Valles Marineris within two phases of bidirectional extension. The second system of faults has been generated by the radial oblate stress tensor related to the formation of the small shield volcanoes in Syria Planum. However, the third system is likely related to the external driving process, probably in the Tharsis province. We classified pits in four evolutionary stages based on their morphometric attributes. We believe that the formation of the pit chains in Noctis Labyrinthus is related to a surface collapse after a pressure drop related to the magma chamber deflation associated with Syria Planum volcanic province. We propose a deformational model based on early extension and magmatic plumbing as driving processes for the formation of Noctis Labyrinthus.

Mayssa El Yazidi↗

Procurement Analysis Tool (PAT)

This a poster on PAT for the CESA National Energy Summit for States: Navigating Energy Trends and Federal Programs Conference.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗

Structural and lithologic study of Northern Coast Range and Sacramento Valley, California

The author has identified the following significant results. Preliminary analysis of the data received has disclosed two potentially important northwest-trending systems of linear features within the Northern California Coast Ranges. A third system, which trends northeast, can be traced with great uncertainty across the alluviated part of the Sacramento Valley and into the foothills of the Sierra Nevada. These linear features may represent fault systems or zones of shearing. Of interest, although not yet verified, is the observation that some of the mercury concentrations and some of the geothermally active areas of California may be located at the intersection of the Central and the Valley Systems. One, perhaps two, stratigraphic unconformities within the Late Mesozoic sedimentary rocks were detected during preliminary examination of the imagery; however, more analysis is necessary in order to verify this preliminary interpretation. A heretofore unrecognized, large circular depression, about 15 km in diameter, was detected within the alluviated part of the Sacramento Valley. The depression is adjacent to a large laccolithic intrusion and may be geologically related to it. Changes in the photogeologic characteristics of this feature will continue to be monitored.

Rich, E. I.↗

Transient Triplet Metallopnictinidenes M–Pn (M = Pd II , Pt II ; Pn = P, As, Sb): Characterization and Dimerization

Nitrenes (R–N) have been subject to a large body of experimental and theoretical studies. The fundamental reactivity of this important class of transient intermediates has been attributed to their electronic structures, particularly the accessibility of triplet vs singlet states. In contrast, electronic structure trends along the heavier pnictinidene analogues (R–Pn; Pn = P–Bi) are much less systematically explored. We here report the synthesis of a series of metallodipnictenes, {M–Pn=Pn–M} (M = Pd II , Pt II ; Pn = P, As, Sb, Bi) and the characterization of the transient metallopnictinidene intermediates, {M–Pn} for Pn = P, As, Sb. Structural, spectroscopic, and computational analysis revealed spin triplet ground states for the metallopnictinidenes with characteristic electronic structure trends along the series. In comparison to the nitrene, the heavier pnictinidenes exhibit lower-lying ground state SOMOs and singlet excited states, thus suggesting increased electrophilic reactivity. Furthermore, the splitting of the triplet magnetic microstates is beyond the phosphinidenes {M–P} dominated by heavy pnictogen atom induced spin–orbit coupling.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Alpha-heating analysis of burning plasma and ignition experiments on the National Ignition Facility

A recent experiment conducted on the National Ignition Facility (NIF) described in the study by Abu-Shawareb et al. achieved a fusion yield output of 1.3 MJ from ~ 220 kJ of x-ray energy absorbed by the capsule, demonstrating remarkable progress in the field of laser driven inertial confinement fusion. In the study by A. R. Christopherson [“Effects of charged particle heating on the hydrodynamics of inertially confined plasmas,” Ph.D. thesis (2020)], the plasma conditions needed to claim the onset of ignition and burn propagation were outlined and multiple criterion were provided to assess progress in inertial fusion experiments. In this work, we modify the metrics from A. R. Christopherson to accurately calculate performance metrics for indirect-drive experiments on the NIF. We also show that performance metric trends observed in NIF data are consistent with theory and simulations. This analysis indicates that all the identified criterion for ignition and burn propagation have been exceeded by experiment 210 808.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

The suitability of selected multidisciplinary design and optimization techniques to conceptual aerospace vehicle design

Four methods for preliminary aerospace vehicle design are reviewed. The first three methods (classical optimization, system decomposition, and system sensitivity analysis (SSA)) employ numerical optimization techniques and numerical gradients to feed back changes in the design variables. The optimum solution is determined by stepping through a series of designs toward a final solution. Of these three, SSA is argued to be the most applicable to a large-scale highly coupled vehicle design where an accurate minimum of an objective function is required. With SSA, several tasks can be performed in parallel. The techniques of classical optimization and decomposition can be included in SSA, resulting in a very powerful design method. The Taguchi method is more of a 'smart' parametric design method that analyzes variable trends and interactions over designer specified ranges with a minimum of experimental analysis runs. Its advantages are its relative ease of use, ability to handle discrete variables, and ability to characterize the entire design space with a minimum of analysis runs.

Olds, John R.↗

The Sagittarius stream in Gaia Early Data Release 3 and the origin of the bifurcations

The Sagittarius dwarf spheroidal (Sgr) is a dissolving galaxy being tidally disrupted by the Milky Way (MW). Its stellar stream still poses serious modelling challenges, which hinders our ability to use it effectively as a prospective probe of the MW gravitational potential at large radii. Our goal is to construct the largest and most stringent sample of stars in the stream with which we can advance our understanding of the Sgr-MW interaction, focusing on the characterization of the bifurcations. We improved on previous methods based on the use of the wavelet transform to systematically search for the kinematic signature of the Sgr stream throughout the whole sky in the Gaia data. We then refined our selection via the use of a clustering algorithm on the statistical properties of the colour-magnitude diagrams. Our final sample contains more than 700 000 candidate stars and is three times larger than previous Gaia samples. With it, we have been able to detect the bifurcation of the stream in both the northern and southern hemispheres, which requires four branches (two bright and two faint) to fully describe the system. We present the detailed proper motion distribution of the trailing arm as a function of the angular coordinate along the stream, showing, for the first time, the presence of a sharp edge (on the side of the small proper motions) beyond which there are no Sgr stars. We also characterize the correlation between kinematics and distance. Finally, the chemical analysis of our sample shows that the faint branch of the bifurcation is more metal poor than the bright. We provide analytical descriptions for the proper motion trends as well as for the sky distribution of the four branches of the stream. Based on our analysis, we interpret the bifurcations as a misaligned overlap of the material stripped at the antepenultimate pericentre (faint branches) with the stars ejected at the penultimate pericentre (bright branch), given that Sgr just went through its perigalacticon. The source of this misalignment is still unknown, but we argue that models with some internal rotation in the progenitor – at least during the time of stripping of the stars that are now in the faint branches – are worth exploring.

79 ASTRONOMY AND ASTROPHYSICS↗

Collaborative Study of Analysis of High Resolution Infrared Atmospheric Spectra Between NASA Langley Research Center and the University of Denver

The Langley-D.U. collaboration on the analysis of high resolution infrared atmospheric spectra covered a number of important studies of trace gases identification and quantification from field spectra, and spectral line parameters analysis. The collaborative work included: Quantification and monitoring of trace gases from ground-based spectra available from various locations and seasons and from balloon flights. Studies toward identification and quantification of isotopic species, mostly oxygen and Sulfur isotopes. Search for new species on the available spectra. Update of spectroscopic line parameters, by combining laboratory and atmospheric spectra with theoretical spectroscopy methods. Study of trends of atmosphere trace constituents. Algorithms developments, retrievals intercomparisons and automatization of the analysis of NDSC spectra, for both column amounts and vertical profiles.

Goldman, Aaron↗

Precursor reaction pathway leading to BiFeO 3 formation: insights from text-mining and chemical reaction network analyses

BiFeO 3 (BFO) is a next-generation non-toxic multiferroic material with applications in sensors, memory devices, and spintronics, where its crystallinity and crystal structure directly influence its functional properties. Designing sol–gel syntheses that result in phase-pure BFO remains a challenge due to the complex interactions between metal complexes in the precursor solution. Here, we combine text-mined data and chemical reaction network (CRN) analysis to obtain novel insight into BFO sol–gel precursor chemistry. We perform text-mining analysis of 340 synthesis recipes with the emphasis on phase-pure BFO and identify trends in the use of precursor materials, including that nitrates are the preferred metal salts, 2-methoxyethanol (2 ME) is the dominant solvent, and adding citric acid as a chelating agent frequently leads to phase-pure BFO. Our CRN analysis reveals that the thermodynamically favored reaction mechanism between bismuth nitrate and 2ME interaction involves partial solvation followed by dimerization, contradicting assumptions in previous literature. We suggest that further oligomerization, facilitated by nitrite ion bridging, is critical for achieving the pure BFO phase.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Effects of fuel composition and octane sensitivity on polycyclic aromatic hydrocarbon and soot emissions of gasoline–ethanol blend surrogates

The sooting propensity of a fuel is closely coupled with the fuel composition and chemistry. A detailed understanding of their effects is, therefore, needed to develop next-generation fuels which can minimize particulate emissions. With this overarching goal, the present work numerically investigates the effects of fuel composition and octane sensitivity (S) on polycyclic aromatic hydrocarbons (PAH) and soot emissions, for four-component gasoline-ethanol blend surrogates comprising isooctane, n-heptane, toluene, and ethanol. A partially-premixed counterflow flame is chosen as the canonical configuration for this study and simulations are performed using CHEMKIN-Pro-employing a kinetic mechanism developed by Park et al. (2017). In addition, a, detailed soot model based on the sectional method is used to capture the spatial characteristics of soot emissions. The kinetic mechanism and soot model are validated using available experimental data for various targets. A total of 86 TPRF-E mixtures, spanning a wide range of concentration of each component, and a wide range of S are analyzed. The effect of each non-paraffinic fuel component on the resultant PAH and soot emissions is investigated. PAH and soot emissions are found to vary significantly depending upon the blend composition. Additionally, based on the parametric sweeps, a regression analysis is carried out to identify global parameters that govern the formation of PAHs and soot. The analysis shows that both toluene content and S have a prominent effect on the formation of PAHs and soot, with toluene content having a stronger impact. Moreover, larger PAHs have higher dependency on toluene content and S. Furthermore, a detailed analysis is carried out to understand the physical and chemical phenomena associated with the observed trends of PAH and soot emissions.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗