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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

Determination of tungsten in geochemical reference material basalt Columbia River 2 by radiochemical neutron activation analysis and inductively coupled plasma mass spectrometry

Environmental tungsten (W) analyses are inhibited by a lack of reference materials and practical methods to remove isobaric and radiometric interferences. We present a method that evaluates the potential use of commercially available sediment, Basalt Columbia River-2 (BCR-2), as a reference material using neutron activation analysis (NAA) and mass spectrometry. Tungsten concentrations using both methods are in statistical agreement at the 95% confidence interval (92 ± 4 ng/g for NAA and 100 ±7 ng/g for mass spectrometry) with recoveries greater than 95%. These results indicate that BCR-2 may be suitable as a reference material for future studies.

38 RADIATION CHEMISTRY, RADIOCHEMISTRY, AND NUCLEA↗

Preparation and calibration of a 231 Pa reference material

A 231 Pa reference material has been characterized for amount of protactinium. This reference material is primarily intended for calibration of 233 Pa tracers produced for 235 U– 231 Pa model age measurements associated with nuclear forensics and nuclear safeguards. Primary measurements for characterization were made by isotope dilution mass spectrometry of a purified 231 Pa solution using a 233 Pa isotopic spike. The spike was calibrated by allowing multiple aliquots of the 233 Pa spike solution to decay to 233 U and then measuring the ingrown 233 U by isotope dilution mass spectrometry using a certified uranium assay and isotopic standard as a reverse-spike. In conclusion, the new 231 Pa reference material will simplify calibration of the 233 Pa isotope dilution spikes, provide metrological traceability, and potentially reduce the overall measurement uncertainty of model ages.

231Pa↗

Updated uranium reference material 231 Pa/ 235 U consensus model ages for nuclear forensics

Radiochronometry provides the model age of nuclear materials, which is useful for understanding the production history of materials found outside of regulatory control. Certified reference materials (CRMs) are important for radiochronometry to increase confidence in measurement quality; however, the absence of 231 Pa/ 235 U CRMs necessitates that nuclear forensic laboratories measure the 231 Pa/ 235 U model ages of preexisting uranium reference materials. Here, in this work, new consensus 231 Pa/ 235 U model ages are reported from three nuclear forensic laboratories for three reference materials using current analytical methods. These updated consensus values can be used for quality control of 231 Pa/ 235 U model age measurements.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

A new HALEU isotopic certified reference material

Candidate certified reference material (CRM) U196 was prepared by gravimetrically mixing and dissolving NNSA NRMP CRM 112-A (natural uranium metal) and CRM 116-A (highly enriched 93.2% 235 U metal) to achieve a high-assay low-enriched uranium (HALEU) isotopic abundance reference material. CRM U196 will be certified for the 233 U/ 238 U, 234 U/ 238 U, 235 U/ 238 U, and 236 U/ 238 U ratios. Gravimetrically determined uranium isotope amount ratios and values derived from the isotope data were calculated from the buoyancy corrected mass data and from certified values for the metal CRMs used to create the solution. The 235 U isotope amount fraction (·100) and expanded uncertainty is 19.5846 ± 0.0028. For attribute verification, total evaporation and modified total evaporation isotope ratio measurements were performed. In conclusion, the reference material is to be distributed as a unit containing 5 mg uranium as dry uranyl nitrate.

High-assay low-enriched uranium↗

Tri-peptide reference structures for the calculation of relative solvent accessible surface area in protein amino acid residues

Relative amino acid residue solvent accessibility values allow the quantitative comparison of atomic solvent-accessible surface areas in different residue types and physical environments in proteins and in protein structural alignments. Geometry-optimised tri-peptide structures in extended solvent-exposed reference conformations have been obtained for 43 amino acid residue types at a high level of quantum chemical theory. Significant increases in side-chain solvent accessibility, offset by reductions in main-chain atom solvent exposure, were observed for standard residue types in partially geometry-optimised structures when compared to non-minimised models built from identical sets of proper dihedral angles abstracted from the literature. Optimisation of proper dihedral angles led most notably to marked increases of up to 54% in proline main-chain atom solvent accessibility compared to literature values. Similar effects were observed for fully-optimised tri-peptides in implicit solvent. The relief of internal strain energy was associated with systematic variation in N, C α and C β atom solvent accessibility across all standard residue types. The results underline the importance of optimisation of ‘hard’ degrees of freedom (bond lengths and valence bond angles) and improper dihedral angle values from force field or other context-independent reference values, and impact on the use of standardised fixed internal co-ordinate geometry in sampling approaches to the determination of absolute values of protein amino acid residue solvent accessibility. Finally, quantum chemical methods provide a useful and accurate alternative to molecular mechanics methods to perform energy minimisation of peptides containing non-standard (chemically modified) amino acid residues frequently present in experimental protein structure data sets, for which force field parameters may not be available. Reference tri-peptide atomic co-ordinate sets including hydrogen atoms are made freely available.

59 BASIC BIOLOGICAL SCIENCES↗

Producing 236 U reference standards for Accelerator Mass Spectrometry at the University of Notre Dame

36 U is a rare isotope of uranium, naturally occurring in ores with an abundance of 236 U/ 238 U$<$ 1 x 10 -9 . The ability to detect it and make isotopic ratio measurements has applications ranging from nuclear forensics and nonproliferation to energy production and environmental protection. Currently, Accelerator Mass Spectrometry (AMS) is the only technique sensitive enough to accurately measure 236 U/ 238 U isotopic ratios as they exist in naturally occurring ores in the range of 236 U/ 238 U = 10 -12 $-$ 10 -9 . Some AMS facilities have demonstrated their capabilities to make these measurements. Historically, the lack of commercially available reference standards covering the range of naturally occurring 236 U/ 238 U abundances has necessitated the use of absolute measurements, notoriously difficult to do using AMS, resulting in increased uncertainties in measurements and a reliance on knowledge of systematic effects. To mitigate these issues, various AMS facilities have sought to develop their own reference standards. Using a reference standard prepared for other forms of mass spectrometry, a series of AMS suitable standards was created through dilution with low-background natural uranium. The techniques used to produce and characterize these materials as well as analysis of them using AMS will be discussed.

236U↗

Ab initio coupled-cluster and multi-reference configuration interaction studies of the low-lying electronic states of 1,2,3,4-cyclobutanetetraone

In this paper, the four, closely spaced, lowest energy electronic states of the challenging, D 4h -symmetric, 1,2,3,4-cyclobutanetetraone (C 4 O 4 ) molecule have been investigated using high-level ab initio methods. The calculated states include the closed-shell singlet 8π( 1 A 1g ) state, the singlet 10π( 1 A 1g ) state, in which the π-type lowest unoccupied molecular orbital (LUMO) of the 8π( 1 A 1g ) reference is doubly occupied and the σ-type highest occupied molecular orbital (HOMO) is empty, and the open-shell singlet and triplet states, designated as 9π( 1 B 2u ) and 9π( 3 B 2u ), respectively, originating from single occupancy of the HOMO and LUMO. Our focus is on single-reference coupled-cluster (CC) approaches capable of handling electronic near-degeneracies in diradicals, especially the completely renormalised CR-CC(2,3) and active-space CCSDt methods, along with their CCSD and EOMCCSD counterparts. The internally contracted multi-reference configuration interaction calculations with a quasi-degenerate Davidson correction are performed as well. Our computations demonstrate that the state ordering is 9π( 3 B 2u ) < 8π( 1 A 1g ) < 9π( 1 B 2u ) < 10π( 1 A 1g ) and that the 8π( 1 A 1g ) - 9π( 3 B 2u ) gap is in the 7–11 kJ/mol range, in reasonable agreement with the negative ion photoelectron spectroscopy measurements, which give 6.27 ± 0.5 kJ/mol. Finally, in addition to the theory level used, geometry relaxation and basis set play a significant role in determining the state ordering and energy spacings. In particular, it is unsafe to use lower level, non-CC geometries and smaller basis sets.

1,2,3,4-cyclobutanetetraone↗

Aeroelastic code comparison using the IEA 22MW reference turbine

Reference wind turbine designs and the associated aeroelastic models are widely used in both research and industry. Reference models representing future concepts are of particular interest. Current state of the art aeroelastic tools are relied upon to design the next generation of large wind turbines. However, modelling assumptions may be invalidated by upcoming very large turbines, and different aeroelastic tools may give inconsistent results. A 22MW turbine model has been defined as part of International Energy Agency (IEA) Wind Task 55 on Reference Wind Turbines and Farms to represent future turbines to be deployed in the 2030s. In this study, an aeroelastic model of this turbine has been created in four tools; Bladed, HAWC2, OpenFAST, and QBlade. Code comparisons are presented for steady state operation, linear stability analysis, and time domain power production simulations in steady and turbulent wind. Generally, the codes show a good agreement, but with some differences present in the linear stability analysis, periodic azimuthal variation, and time domain simulations. The models are a good basis for further study with the IEA 22MW turbine, and further code comparison exercises.

17 WIND ENERGY↗

NREL 15-kW: An Advanced Horizontal-Axis Reference Turbine for Distributed Wind

Distributed wind energy can play a significant role in the renewable energy landscape. A recent study conducted by the National Renewable Energy Laboratory (NREL) identified the lack of availability and utilization of reference wind turbine models as a major hindrance in the development of the distributed wind energy technology sector, even though such models are widely used in offshore and land-based wind research. Therefore, NREL is developing three reference wind turbine architectures, also called archetypes, for distributed wind energy applications. This paper describes the detailed design and modeling of the first of the three reference turbine archetypes, called the NREL 15-kW turbine. It is a passive-yaw, upwind turbine with a rated power of 15 kW.

17 WIND ENERGY↗

Evaluation of Photodiode-Based Pyranometers and Reference Solar Cells on a Two-Axis Tracking System

The performance of photodiode-based pyranometers and reference solar cells are examined on a two-axis tracker surface. This is the third in a series of papers examining the performance of photodiode-based pyranometers and reference solar cells on fixed and tracking surfaces. Because the instruments are oriented normally to the incident radiation, angle-of-incidence effects are minimized. By removing the angle-of-incidence effects inherent in earlier studies, the change in the sensor's clear sky responsivity can be more clearly identified. It was found that the photodiode-based pyranometers demonstrate a larger change in responsivity than the reference solar cells. Spectral measurements are recommended to verify the cause of this difference.

14 SOLAR ENERGY↗

NREL's Improved Linearity Testing of Photovoltaic Reference Cells

Photovoltaic devices are characterized under standard testing conditions that include a defined reference spectrum and total irradiance. International standards for reference cell calibrations require that reported reference cell response (typically Isc) vs. total irradiance must be linear. How can linearity be efficiently determined? In 2006 NREL developed a test bed, based on the "two-lamp method" that provided a low cost, but low accuracy method for determining whether cell response was linear with irradiance. This paper describes very simple changes to NREL's historical method [1] for determining linearity that yield greatly improved results. It also describes a method that can be used to quantify and correct for non-linearity.

41 EE - Solar Energy Technologies Office (EE-4S)↗

The Integrated Reference Region Analysis for Parallel DFIGs’ Interfacing Inductors

Although the traditional design of doubly-fed induction generators (DFIGs)’ interfacing inductors consider the peak ripple of the grid-side converter (GSC)’s output current, it does not consider the inductors’ impact on DFIGs’ smallsignal stability. Located in series between the GSC and the stator, the inappropriate selection of the interfacing inductor can easily result to system instability. Therefore, this paper first proposes the integrated reference region analysis for small wind farm's interfacing inductors to improve the traditional design method. Firstly, a new detailed parallel DFIGs’ smallsignal model that considers output currents’ coupling is built in d-q coordinate system with state-space approach. The model focuses on representing the operating states of parallel DFIGs in wind farm. Secondly, the linearized state-space matrix of parallel DFIGs is decomposed into nominal-value matrix and location matrix. Considering the traditional design requirements, the integrated reference region for interfacing inductor is proposed through spectral radius and bialternate matrix sum (BMS). Furthermore, it can provide better guidance for parameter selecting and stabilization method researches. Finally, the simulation and experimental results show that the proposed integrated reference region for parallel DFIGs’ interfacing inductors is accurate and instructive.

47 OTHER INSTRUMENTATION↗

Testing Lithium-Ion Battery with the Internal Reference Electrode: An Insight into the Blocking Effect

Long-term stability of reference electrode is a major issue in lithium-ion batteries. A composite Ni-Li reference electrode (RE) with a longer lifetime than traditional Cu-wire Li reference electrodes is proposed in this study. However, the larger size of the Ni-Li RE creates a blocking effect when positioned internally in the battery. The blocking effect manifests as an abnormal feature in the measured electrode potential. A two-dimensional (2D) finite element model of the cell with an internal RE is constructed to investigate the mechanism of the blocking effect. The internal RE blocks the path of local current flow in the electrolyte, and decreases the electrochemical reaction rate of particles in the anode and cathode, leading to measurement errors. Characteristic lengths of RE and applied currents were examined as parameters in the finite element model to determine their effect on the magnitude of error. A useful guide is provided for proper selection of size of RE and applied current in dynamic tests of lithium-ion batteries.

2-D finite element model↗

Similarities and differences between variants called with human reference genome HG19 or HG38

Reference genome selection is a prerequisite for successful analysis of next generation sequencing (NGS) data. Current practice employs one of the two most recent human reference genome versions: HG19 or HG38. To date, the impact of genome version on SNV identification has not been rigorously assessed. We conducted analysis comparing the SNVs identified based on HG19 vs HG38, leveraging whole genome sequencing (WGS) data from the genome-in-a-bottle (GIAB) project. First, SNVs were called using 26 different bioinformatics pipelines with either HG19 or HG38. Next, two tools were used to convert the called SNVs between HG19 and HG38. Lastly we calculated conversion rates, analyzed discordant rates between SNVs called with HG19 or HG38, and characterized the discordant SNVs. The conversion rates from HG38 to HG19 (average 95%) were lower than the conversion rates from HG19 to HG38 (average 99%). The conversion rates varied slightly among the various calling pipelines. Around 1.5% SNVs were discordantly converted between HG19 or HG38. The conversions from HG38 to HG19 had more SNVs which failed conversion and more discordant SNVs than the opposite conversion (HG19 to HG38). Most of the discordant SNVs had low read depth, were low confidence SNVs as defined by GIAB, and/or were predominated by G/C alleles (52% observed versus 42% expected). A significant number of SNVs could not be converted between HG19 and HG38. Based on careful review of our comparisons, we recommend HG38 (the newer version) for NGS SNV analysis. To summarize, our findings suggest caution when translating identified SNVs between different versions of the human reference genome.

59 BASIC BIOLOGICAL SCIENCES↗

PV Reference Cells for Outdoor Use: Comparison of First-Year Field Measurements

Reference cells are widely used in the photovoltaic (PV) industry to measure irradiance. For field applications and outdoor use, a variety of products are on the market, and they are often perceived as low-cost alternatives to thermopile pyranometers. But reference cell characteristics, such as directional and spectral response, fundamentally differ from pyranometers, and measurements made by the former cannot be substituted for or directly compared with the latter. The National Renewable Energy Laboratory's (NREL's) Solar Radiation Research Laboratory is currently in a multiyear effort to develop guidance and recommendations for the design and use of outdoor reference cells, with a view to reducing inconsistencies and measurement uncertainty. The core of this effort is the long-term deployment of multiple products from different manufacturers that are mounted at a fixed tilt, on a single-axis tracker, and on a dual-axis tracker. This report provides an analysis of the data collected during the first year of operation at the NREL location. An overall assessment is made by comparing the total energy measured by each instrument to the other instruments having the same orientation. These totals are calculated for three different scenarios: (1) using the factory calibration factors, (2) using the previously determined NREL Cell Lab calibration factors, and (3) using the newly determined field calibration factors derived from the recorded measurements. Because the true or correct measurement values are unknown, pair-wise comparisons are made. The results show that the difference between the highest and lowest measured energy can exceed 3% when using the factory calibration factors. Consistency among instruments improves when Cell Lab calibrations are used, and it further improves when using field calibration factors.

14 SOLAR ENERGY↗

The Baseline Performance Reference for Irradiance in PV System Applications

This report proposes the definition of a new baseline performance reference (BPR). The definition goes beyond existing standards pertaining to photovoltaic (PV) reference cells and devices to define the response under all possible operating conditions in the field. Field evaluations using BPR devices will be more sensitive to performance anomalies than pyranometers because they track PV system power output more closely. At the same time, they will be able to detect a broader range of performance anomalies than traditional matched reference devices, which might have matching defects. The BPR definition also opens the door to new practices in resource assessment and yield prediction. Solar resource data can be collected or modeled and validated directly as BPR irradiance, and PV system simulations based on BPR irradiance need fewer assumptions and less processing to obtain the effective irradiance on modules. As a result, lower uncertainty in yield assessments can be expected.

14 SOLAR ENERGY↗

International Energy Agency 22 MW Offshore Reference Wind Turbine

The presentation will be used in a public webinar to introduce the newly developed 22 megawatt offshore reference wind turbine designed within the International Energy Agency Wind Technology Commercialization Programme Task 55 Reference Wind Turbines and Plants. The turbine was designed collaboratively by two teams at the Denmark Technical University and at the National Renewable Energy Laboratory. Reference turbines serve an important purpose in the wind energy community, since they provide openly available data for models representative of current wind turbine technology, which can be used by practitioners for a variety of modeling purposes, ranging from aerodynamic, structural, and aeroelastic turbine modeling to wind farm flow modeling, across a range of fidelities. The IEA 22 RWT aims to model machines with projected installation in the 2025-2030 time frame. The turbine has a rotor diameter of 284 meters and a hub height of 170 meters. It is a class 1-B machine with a rotor specific power nearing 350 W m-2 and it is mounted on either a fixed-bottom offshore foundation or a semi-submersible floating platform.

17 WIND ENERGY↗

Highly Resolved Reference Projections of Building Energy Use for the Contiguous United States: Building Sector Energy Baselines, Projection Methods, and Results

This report describes one methodology of projecting energy consumption of the US residential and commercial building sectors using NREL's ResStock™ and ComStock™ as well as growth rates derived from EIA's Annual Energy Outlook (AEO). The impetus for this work is to provide an intermediate method for compiling demand-side sectoral energy projections that is suitable for grid-scale analysis, such as NREL's Standard Scenarios. ResStock and ComStock are physics-based and statistically representative building stock models of the US residential and commercial sector, respectively. Using the 2012 actual meteorological year (AMY) weather data, the sectoral energy baselines are simulated and then segmented along key dimensions (e.g., geography, dwelling/building type). The segmented results are then scaled using the corresponding annual growth rates derived from the 2021 AEO reference case to produce energy projections out to 2050. The compiled result is a demand-side grid model (dsgrid) data set suitable for use in NREL's large-scale grid models, such as the Regional Energy Deployment System (ReEDS). This simple projection method does not endogenously represent how the building stock could evolve through time. Most notably, it does not reflect large-scale electrification, for example, the conversion of space heating, water heating, clothes drying, and cooking from primary fossil fuels to electricity, as this is not part of AEO's reference case assumptions. Nonetheless this approach is more resolved and potentially extensible compared to the current method used by Standard Scenarios's reference case, which augments a sector's total load based on a single growth rate from AEO.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗