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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 307 records · Page 17

Modeling X-Ray Thomson Scattering Spectra of Warm Dense Matter

Warm dense matter (WDM) is sometimes described as a \solid density plasma" where neither weakly coupled plasma theory nor condensed matter theory are applicable. More specifically, WDM has densities of ~ 0:1 - 50 times solid density, temperatures of ~ 1 - 100 eV, is partially ionized, globally neutral, has strongly correlated particles (due to interactions), and partial electron degeneracy. In nature, WDM may be found in the interiors of planets such as Jupiter or in the envelopes of white dwarf stars, and in man-made processes such as inertial confinement fusion (ICF), WDM exists as a transient state of matter. To model these physical systems, the equation of state as well as opacity, conductivity, and diffusion coefficients must be known. Experimentally WDM is probed with an experimental technique known as X-Ray Thomson Scattering (XRTS). In such an experiment X-rays photons are scattered off of WDM and the resulting photons are measured at a given solid angle. The resulting spectrum gives information on the density and temperature of WDM, but a model of WDM and the scattering experiment is often required to interpret the results. As a result, these experiments also serve as a method of validation for potential models of WDM. The work presented here focuses on the model of WDM proposed by Starrett and Saumon and a model for scattering based off of Chihara’s work. The model proposed by Starrett and Saumon is an average-atom model that is coupled with a two component plasma model, hereafter referred to as an AA+TCP model. The AA+TCP model is an ab initio model with no free parameters, only requiring knowledge of the element under investigation, the density, and the temperature. The outputs from the model completely determine all the input parameters needed for Chihara’s structure function (chemical potential, elastic feature, screening potential, bound-state wavefunctions, and free wavefunctions), which in turn determines the double differential scattering cross-section of the experiment. This approach to determining the outcome of an XRTS experiment parallels that of Johnson, et al., but expands the work in many respects. For example, the AA+TCP model completely determines all the input parameters to the structure function; hence no ad hoc approximations are necessary to close the system. Also, the free-electron feature and the bound-free feature are modified to include collisions and occupation of free electron states, respectively.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

Initial High Temperature Inelastic Constitutive Model for Alloy 617

This report describes progress on a Alloy 617 inelastic constitutive model slated for inclusion in the ASME Boiler & Pressure Vessel Code in Code Case N-898 “Use of Alloy 617 (UNS N06617) for Class A Elevated Temperature Construction, Section III, Division 5” as part of an appendix on inelastic modeling. This appendix will provide a reference material model for A617 for use in conjunction with the ASME design by inelastic analysis criteria. This report focuses on the implementation and evaluation of an existing Alloy 617 model developed to represent the data collected at Idaho National Laboratory (INL) and Oak Ridge National Laboratory (ORNL) as part of the Alloy 617 Code Case experimental campaign. While the model accurately captures the cyclic stress/strain behavior of Alloy 617, it fails to capture the long-term creep and lower temperature tensile data. In addition, the model form is complicated and has over 50 configurable parameters. As such, we recommend the development of a simplified model, incorporating key features of the ORNL model but reducing the model complexity.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

Advanced Modeling Fast Simulation Algorithms for Alternate Arm Converters

There is increasing interest in alternate arm converter (AAC) due to the fault-tolerant characteristics it could offer in high-voltage direct current (HVdc) systems. The simulation of AACs is important to assist with the design of hardware, control systems, and planning of power system expansions. However, simulation of AAC-HVdc using existing software takes a long time due to the presence of a large number of states and non-linear devices. An ultra-fast single-or multi-CPU simulation algorithm to simulate the AAC-HVdc system based on state-space models and using hybrid discretization algorithm with a relaxation technique that reduces the imposed computational burden is presented in this paper. The developed algorithm is validated with respect to reference PSCAD/EMTDC model.

Debnath, Suman↗

KETCHUP: Parameterizing of large-scale kinetic models using multiple datasets with different reference states

Large-scale kinetic models provide the computational means to dynamically link metabolic reaction fluxes to metabolite concentrations and enzyme levels while also conforming to substrate level regulation. However, the development of broadly applicable frameworks for efficiently and robustly parameterizing models remains a challenge. Challenges arise due to both the heterogeneity, paucity, and difficulty in obtaining flux and/or concentration data but also due to the computational difficulties of the underlying parameter identification problem. Both the computational demands for parameterization, degeneracy of obtained parameter solutions and interpretability of results has so far limited widespread adoption of large-scale kinetic models despite their potential. Herein, we introduce the Kinetic Estimation Tool Capturing Heterogeneous Datasets Using Pyomo (KETCHUP), a flexible parameter estimation tool that leverages a primal-dual interior-point algorithm to solve a nonlinear programming (NLP) problem that identifies a set of parameters capable of recapitulating the (non)steady-state fluxes and concentrations in wild-type and perturbed metabolic networks. KETCHUP is benchmarked against previously parameterized large-scale kinetic models demonstrating an at least an order of magnitude faster convergence than the tool K-FIT while at the same time attaining better data fits. Finally, this versatile toolbox accepts different kinetic descriptions, metabolic fluxes, enzyme levels and metabolite concentrations, under either steady-state or instationary conditions to enable robust kinetic model construction and parameterization. KETCHUP supports the SBML format and can be accessed at https://github.com/maranasgroup/KETCHUP.

59 BASIC BIOLOGICAL SCIENCES↗

Accounting for Training Data Error in Machine Learning Applied to Earth Observations

Remote sensing, or Earth Observation (EO), is increasingly used to understand Earth system dynamics and create continuous and categorical maps of biophysical properties and land cover, especially based on recent advances in machine learning (ML). ML models typically require large, spatially explicit training datasets to make accurate predictions. Training data (TD) are typically generated by digitizing polygons on high spatial-resolution imagery, by collecting in situ data, or by using pre-existing datasets. TD are often assumed to accurately represent the truth, but in practice almost always have error, stemming from (1) sample design, and (2) sample collection errors. The latter is particularly relevant for image-interpreted TD, an increasingly commonly used method due to its practicality and the increasing training sample size requirements of modern ML algorithms. TD errors can cause substantial errors in the maps created using ML algorithms, which may impact map use and interpretation. Despite these potential errors and their real-world consequences for map-based decisions, TD error is often not accounted for or reported in EO research. Here we review the current practices for collecting and handling TD. We identify the sources of TD error, and illustrate their impacts using several case studies representing different EO applications (infrastructure mapping, global surface flux estimates, and agricultural monitoring), and provide guidelines for minimizing and accounting for TD errors. To harmonize terminology, we distinguish TD from three other classes of data that should be used to create and assess ML models: training reference data, used to assess the quality of TD during data generation; validation data, used to iteratively improve models; and map reference data, used only for final accuracy assessment. We focus primarily on TD, but our advice is generally applicable to all four classes, and we ground our review in established best practices for map accuracy assessment literature. EO researchers should start by determining the tolerable levels of map error and appropriate error metrics. Next, TD error should be minimized during sample design by choosing a representative spatio-temporal collection strategy, by using spatially and temporally relevant imagery and ancillary data sources during TD creation, and by selecting a set of legend definitions supported by the data. Furthermore, TD error can be minimized during the collection of individual samples by using consensus-based collection strategies, by directly comparing interpreted training observations against expert-generated training reference data to derive TD error metrics, and by providing image interpreters with thorough application-specific training. We strongly advise that TD error is incorporated in model outputs, either directly in bias and variance estimates or, at a minimum, by documenting the sources and implications of error. TD should be fully documented and made available via an open TD repository, allowing others to replicate and assess its use. To guide researchers in this process, we propose three tiers of TD error accounting standards. Finally, we advise researchers to clearly communicate the magnitude and impacts of TD error on map outputs, with specific consideration given to the likely map audience.

58 GEOSCIENCES↗

Primary Reference Cell Calibrations with Reduced Measurement Uncertainty

This paper presents an overview of the improvements made since 2014 to the primary reference cell calibrations performed at the National Renewable Energy Laboratory (NREL). Reducing the measurement uncertainty of the calibrations was the primary goal of the improvements, which were used during the recent calibrations conducted in the autumn of 2016. Changes and improvements have been made to the spectral irradiance and short-circuit current measurements, spectral irradiance modeling, and reference cell temperature corrections. Almost 6000 points were collected on 38 reference cells. Analysis of the results demonstrated reductions of expanded uncertainty from +/-1.0-1.2% in previous years down to +/-0.4-0.5% for crystalline-Si reference cells.

14 SOLAR ENERGY↗

Model for Deriving the Direct Normal and Diffuse Horizontal Irradiance from the Global Tilted Irradiance

We developed a separation model for deriving the direct normal irradiance (DNI) and the diffuse horizontal irradiance (DHI) from the global tilted irradiance (GTI). The model is based on the DIRINT model, but substitutes the use of the GTI in place of the global horizontal irradiance (GHI) for determining the global clearness index (Kt). Additionally, an iterative method is used to adjust Kt to improve the derived values of the DNI and the DHI. The model is referred to as the GTI-DIRINT model. When using for model input the GTI measured with a pyranometer tilted at a small angle from the horizontal (10°), the deviations between the measured DNI and DHI and the GTI-DIRINT-modeled DNI and DHI were essentially the same as those for the DIRINT model when using the GHI for model input. Increasing the tilt angle from horizontal (as great as 44° for Eugene, Oregon) increased the deviations between the modeled and measured DNI and DHI, but our results were still reasonable. The GTI-DIRINT model provides reasonable values of DNI and DHI from the GTI, and if they are subsequently used with the Perez tilted surface model to model the GTI for orientations within 30° of the azimuth and tilt of the GTI used for model input, the result is as good or better than may be obtained when using a measured DNI and DHI, and without their significant instrumentation cost.

14 SOLAR ENERGY↗

Key Factors for Determining Risk of Groundwater Impacts Due to Leakage from Geologic Carbon Sequestration Reservoirs

The National Risk Assessment Partnership (NRAP) is developing a science-based toolset for the analysis of potential impacts to groundwater chemistry from CO 2 injection (www.netldoe.gov/nrap). The toolset adopts a stochastic approach in which predictions address uncertainties in shallow underwater and leakage scenarios. It is derived from detailed physics and chemistry simulation results that are used to train more computationally efficient models,l referred to here as reduced-order models (ROMs), for each component system. In particular, these tools can be used to help regulators and operators understand the expected sizes and longevity of plumes in pH, TDS, and dissolved metals that could result from a leakage of brine and/or CO 2 from a storage reservoir into aquifers. This information can inform, for example, decisions on monitoring strategies that are both effective and efficient. We have used this approach to develop predictive reduced-order models for two common types of reservoirs, but the approach could be used to develop a model for a specific aquifer or other common types of aquifers. In this paper we describe potential impacts to groundwater quality due to CO 2 and brine leakage, discuss an approach to calculate thresholds under which "no impact" to groundwater occurs, describe the time scale for impact on groundwater, and discuss the probability of detecting a groundwater plume should leakage occur.

54 ENVIRONMENTAL SCIENCES↗

Contaminant Transport Parameters for the Groundwater Flow and Contaminant Transport Model of Corrective Action Units 101 and 102: Central and Western Pahute Mesa, Nye County, Nevada, Revision 1

This document presents a summary and framework of available transport data and other information directly relevant to the development of the groundwater transport model for Central and Western Pahute Mesa (PM) corrective action units (CAU). This model is referred to as the “PM CAU transport model” in this document. Central and Western PM are two areas of the Nevada National Security Site (NNSS) that historically were used for underground nuclear testing. These nuclear tests resulted in groundwater contamination in the vicinity of the underground test areas. As a result, the U.S. Department of Energy (DOE), Environmental Management (EM) Nevada Program is currently conducting a corrective action investigation (CAI) of the PM underground test areas. This work is a part of the Underground Test Area (UGTA) Activity in accordance with the Federal Facility Agreement and Consent Order (FFACO) (1996, as amended).

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Convex Relaxation of OPF in Multiphase Radial Networks with Wye and Delta Connections

This panel presentation focuses on multiphase radial distribution networks with wye and delta connections, and proposes a semidefinite relaxation of the AC optimal power flow (OPF) problem. Two multiphase power flow models are developed to facilitate the integration of delta-connected loads or generation resources in the OPF problem. The first model is referred to as the extended branch flow model (EBFM). The second model leverages a linear relationship between phase-to-ground power injections and delta connections that holds under a balanced voltage approximation (BVA). Based on these models, pertinent OPF problems are formulated and relaxed to semidefinite programs (SDPs). Numerical studies on IEEE test feeders show that the proposed SDP relaxations can be solved efficiently by a generic optimization solver. Numerical evidence also indicates that solving the resultant SDP under BVA is faster than under EBFM. Moreover, both SDP solutions are numerically exact with respect to voltages and branch flows. It is further shown that the SDP solution under BVA has a small optimality gap, and the BVA model is accurate in the sense that it reproduces actual system voltages.

24 POWER TRANSMISSION AND DISTRIBUTION↗

1:70-Scale Model Testing of the Reference OpenSource Controller (ROSCO) on the IEA-Wind 15MW Reference Wind Turbine Including Floating Feedback: Preprint

This paper presents results from the Floating Offshore-wind Controls Advanced Laboratory (FOCAL) Experimental campaign performed at the University of Maine's (UMaine's) Harold Alfond Wind/Wave Ocean Engineering Laboratory (W2). The project involves four Froude-scaled test campaigns considering the International Energy Agency (IEA) Wind 15MW Reference Wind Turbine deployed on the VolturnUS-S semi-submersible platform with tuned-mass damper (TMD) elements in the hull. The turbine employs real-time rotor torque and blade pitch control through the Reference OpenSource Controller (ROSCO), including the additional control strategies of ROSCO's thrust peak shaving and a floating feedback control loop. Results with the floating feedback control are considered in this paper and show a significant reduction in platform pitch motion and loads around the platform pitch natural frequency with minimal negative impact of rotor power quality.

controls↗

Utah FORGE Well 16A(78)-32 Stimulation DFN Fracture Plane Evaluation and Data

This dataset includes files used to fit planar fractures through the preliminary earthquake catalogs of the three stages of the April 2022 well 16A(78)-32 stimulation which is linked bellow. These planar features have been used to update the FORGE reference Discrete Fracture Network (DFN) model. The files are provided to encourage other modelers to use additional workflows to find additional/alternative features. To this end, the dataset includes the cleaned earthquake catalog data translated to the FORGE reference model global reference frame, the well trajectory of 16A(78)-32 in those same coordinates, the fit 15 planar features in csv format, and a pdf file with slides illustrating the process used to fit the features. A recorded presentation of this material is available from the October 2022 FORGE Modeling and Simulation Forum which is also linked below.

15 GEOTHERMAL ENERGY↗

Specific absorbed fractions for a revised series of the UF/NCI pediatric reference phantoms: internal photon sources

Assessment of radiation absorbed dose to internal organs of the body from the intake of radionuclides, or in the medical setting through the injection of radiopharmaceuticals, is generally performed based upon reference biokinetic models or patient imaging data, respectively. Biokinetic models estimate the time course of activity localized to source organs. The time-integration of these organ activity profiles are then scaled by the radionuclide S-value, which defines the absorbed dose to a target tissue per nuclear transformation in various source tissues. S-values are computed using established nuclear decay information (particle energies and yields), and a parameter termed the specific absorbed fraction (SAF). The SAF is the ratio of the absorbed fraction—fraction of particle energy emitted in the source tissue that is deposited in the target tissue—and the target organ mass. While values of the SAF may be computed using patient-specific or individual-specific anatomic models, they have been more widely available through the use of computational reference phantoms. In this study, we report on an extensive series of photon SAFs computed in a revised series of the University of Florida and the National Cancer Institute pediatric reference phantoms which have been modified to conform to the specifications embodied in the ICRP reference adult phantoms of Publication 110 (e.g. organs modeled, organ ID numbers, blood contribution to elemental compositions). Following phantom anatomical revisions, photon radiation transport simulations were performed using MCNPX v2.7 in each of the ten phantoms of the series—male and female newborn, 1 year old, 5 year old, 10 year old, and 15 year old—for 60 different tissues serving as source and/or target regions. A total of 25 photon energies were considered from 10 keV to 10 MeV along a logarithm energy grid. Detailed analyses were conducted of the relative statistical errors in the Monte Carlo target tissue energy deposition tallies at low photon energies and over all energies for source–target combinations at large intra-organ separation distances. Based on these analyses, various data smoothing algorithms were employed, including multi-point weighted data smoothing, and log–log interpolation at low energies (1 keV and 5 keV) using limiting SAF values based upon target organ mass to bound the interpolation interval. The final dataset is provided in a series of ten electronic supplemental files in MS Excel format. Finally, the results of this study were further used as the basis for assessing the radiative component of internal electron source SAFs as described in our companion paper (Schwarz et al 2021) for this same pediatric phantom series.

61 RADIATION PROTECTION AND DOSIMETRY↗

Specific absorbed fractions for a revised series of the UF/NCI pediatric reference phantoms: internal electron sources

Assessment of radiation absorbed dose to internal organs of the body from the intake of radionuclides, or in the medical setting through the injection of radiopharmaceuticals, is generally performed based upon reference biokinetic models or patient imaging data, respectively. Biokinetic models estimate the time course of activity localized to source organs. The time-integration of these organ activity profiles are then scaled by the radionuclide S-value, which defines the absorbed dose to a target tissue per nuclear transformation in various source tissues. S-values are computed using established nuclear decay information (particle energies and yields), and a parameter termed the specific absorbed fraction (SAF). The SAF is the ratio of the absorbed fraction—fraction of particle energy emitted in the source tissue that is deposited in the target tissue—and the target organ mass. While values of the SAF may be computed using patient-specific or individual-specific anatomic models, they have been more widely available through the use of computational reference phantoms. In this study, we report on an extensive series of photon SAFs computed in a revised series of the University of Florida and the National Cancer Institute pediatric reference phantoms which have been modified to conform to the specifications embodied in the ICRP reference adult phantoms of Publication 110 (e.g. organs modeled, organ ID numbers, blood contribution to elemental compositions). Following phantom anatomical revisions, photon radiation transport simulations were performed using MCNPX v2.7 in each of the ten phantoms of the series—male and female newborn, 1 year old, 5 year old, 10 year old, and 15 year old—for 60 different tissues serving as source and/or target regions. A total of 25 photon energies were considered from 10 keV to 10 MeV along a logarithm energy grid. Detailed analyses were conducted of the relative statistical errors in the Monte Carlo target tissue energy deposition tallies at low photon energies and over all energies for source–target combinations at large intra-organ separation distances. Based on these analyses, various data smoothing algorithms were employed, including multi-point weighted data smoothing, and log–log interpolation at low energies (1 keV and 5 keV) using limiting SAF values based upon target organ mass to bound the interpolation interval. The final dataset is provided in a series of ten electronic supplemental files in MS Excel format. Finally, the results of this study were further used as the basis for assessing the radiative component of internal electron source SAFs as described in our companion paper (Schwarz et al 2021) for this same pediatric phantom series.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗