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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 1,297 records · Page 72

Commissioning and operation in magnetic field of CMS GE1/1 station

In October and November 2021 the CMS Gas Electron Multiplier (GEM) detectors of station GE1/1 were operated for the first time in presence of a magnetic field in CMS. The phenomena observed in this first period led to performing a test on GE1/1 chambers to study their behaviour in presence of a magnetic field ramp. The magnetic field has been created using the Goliath magnet installed in the CERN North Area. In conclusion, the aim of the test is to determine if a magnetic field ramp causes serious problems to the operation of the GEM chambers and to develop a clear set of procedures, that will permit the safe operations of the GEM chambers during a magnetic field ramp.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

Insights into Chemical Prelithiation of SiO x /Graphite Composite Anodes through Scanning Electron Microscope Imaging

Initial Coulombic efficiency (ICE) is critical for determining the energy density of lithium-ion batteries (LIBs) used for practical applications; however, it is typically disregarded in anode research. We used SiO x and graphite composite anodes for commercial lithium-ion batteries in our preliminary research to achieve a balance between ICE, capacity, and cycling life. ICE reached 88%; however, it needs further improvement for commercial applications. Prelithiation is a process that involves the introduction of extra lithium ions into LIBs during their manufacturing to enhance the overall performance of the LIBs. We applied a chemical prelithiation method on our SiO x /graphite composite anodes, which comprised 95 wt % of the active material mass loading on the electrode. The ICE increased from 88% to 98% using an aryllithium reagent impregnation method within 2 min of prelithiation. The anode’s specific capacity density, rate, and cycle performance also significantly improved. Scanning electron microscopy (SEM) imaging enhanced by an osmium tetroxide staining method indicated that the P-anode contained a stable solid electrolyte interface (SEI) layer after the prelithiation process and cycling electrochemical test. The P-anode’s stable charge differential peak over 500 cycles also showcases a robust artificial SEI layer that was generated by the prelithiation procedure. Here, this prelithiation process has significant potential for adoption in the LIB industry’s current electrode manufacturing process.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Low-cost production method for fluorescent particles for liquid flow velocimetry applications

Abstract In this Technical Note, we present a simple and low-cost production method for fluorescent particles perfectly suitable for velocimetry applications. We leverage the unique ability of Nile Red (NR) fluorophores to adsorb on the polymer surface and/or embed itself in between polymeric chains. The laboratory procedure to dye polyamide particles with NR and monetary advantages over commercially available fluorescent particles is outlined. Subsequently, the fluorescence behavior of the dyed particles is tested under a laser illumination source in polar and non-polar liquids. The distinct advantage of the emission spectrum of NR-dyed particles is demonstrated with sample test results.

42 ENGINEERING↗

Technical Report: Benchmarking for Quasispecies Abundance Inference with Confidence Intervals from Metagenomic Sequence Data

The software application “MetaQuant” was developed by our group at Lawrence Livermore National Laboratory (LLNL). It is designed to profile microbial populations in a sample using data from whole-genome shotgun (WGS) metagenomic DNA sequencing. Several other metagenomic profiling applications have been described in the literature. We ran a series of benchmark tests to compare the performance of MetaQuant against that of a few existing profiling tools, using real and simulated sequence datasets. This report describes our benchmarking procedure and results.

59 BASIC BIOLOGICAL SCIENCES↗

Site 200 #1400 Block Area New Trailers Project, Soil Sampling and Analysis Plan/Quality Assurance Plan

Lawrence Livermore National Laboratory's (LLNL) Project Management Office (PMO) is proposing to install a series of modular trailers and install associated underground utilities in the 1400 Block at the Livermore Site. This Sampling and Analysis Plan (SAP) outlines the processes and procedures to collect environmental and geotechnical soil samples from the project area and to send the samples to the appropriate laboratory or laboratories for analysis or testing. The resulting environmental laboratory data will determine whether excavated soils can be reused on the project, or which type of landfill or landfills the soils may be sent for disposal. This SAP has been prepared and is organized to be consistent with LLNL's Soils Screening and Management Plan (SSMP) (LLNL, 2019), as well as the U.S. Environmental Protection Agency's (EPA) Data Quality Objectives programs (EPA, 2006).

54 ENVIRONMENTAL SCIENCES↗

Fission Product Yield Data Adjustment in a Prototype Version of TSURFER

The TSURFER (Tool for Sensitivity/Uncertainty analysis of Response Functionals using Experimental Results) module of Oak Ridge National Laboratory’s (ORNL’s) SCALE code system has been updated to perform nuclear data adjustments for fixed-source irradiation/depletion problems. TSURFER uses a generalized linear least squares (GLLS) approach to consolidate a prior set of measured responses and corresponding calculated values to create the most self-consistent set of nuclear data. Traditionally, TSURFER adjustments have been performed for multigroup nuclear data such as reaction cross sections. In this work, TSURFER is expanded to perform adjustments to independent fission product yields and branching ratios that need equality constraints. To preserve equality constraints after the data adjustment procedure, an updated GLLS formulation includes a new Lagrange multiplier that forces data adjustment to sum to 0 for a given fission yield/branching ratio parent. A test problem illustrates that the newly updated TSURFER module satisfies the required constraint that adjustments for fission yield data sum to 0.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

TA-18-1 Slotin Building Restoration – Summary of Work to be Performed

The National Historic Preservation Act (NHPA) requires LANL to identify, evaluate, record, and protect eligible historic properties like TA-18-1 Slotin Building. The Environmental Protection and Compliance-Environmental Stewardship (EPC-ES) Cultural Resources program consults with the New Mexico State Historic Preservation Office (SHPO) on undertakings that may affect these properties. TA-18-1 Slotin Building is an exceptionally significant Manhattan Project Property that has been determined eligible for the National Register of Historic Places and is included within the boundary of the Manhattan Project National Historical Park. The building was constructed in 1946 and served as laboratory space for criticality testing. It is the location of the May 1946 criticality accident that resulted in the death of Louis Slotin. As a result of the accident, new procedures and designs for criticality experiments were implemented to prevent further accidents.

96 KNOWLEDGE MANAGEMENT AND PRESERVATION↗

The Initial Development of a Computerized Operator Support System

A computerized operator support system (COSS) is a collection of resilient software technologies to assist operators in monitoring overall nuclear power plant performance and making timely, informed decisions on appropriate control actions for the projected plant condition. The COSS provides rapid assessments, computations, and recommendations to reduce workload and augment operator judgment and decision-making during fast- moving, complex events. A prototype COSS for a chemical volume control system at a nuclear power plant has been developed in order to demonstrate the concept and provide a test bed for further research. The development process identified four underlying elements necessary for the prototype, which consist of a digital alarm system, computer-based procedures, piping and instrumentation diagram system representations, and a recommender module for mitigation actions. An operational prototype resides at the Idaho National Laboratory (INL) using the U.S. Department of Energy’s (DOE) Light Water Reactor Sustainability (LWRS) Human Systems Simulation Laboratory (HSSL). Several human-machine interface (HMI) considerations are identified and incorporated in the prototype during this initial round of development.

99 GENERAL AND MISCELLANEOUS↗

COR-0011 Rev 6 MARVEL Project Code of Record

This Code of Record identifies the codes, standards, and procedures necessary to design, develop, construct, and startup the Microreactor Applications Research Validation and Evaluation (MARVEL) Project at the Materials and Fuel Complex (MFC) Transient Reactor Test (TREAT) Facility and the Idaho National Laboratory (INL). The MARVEL Project is an INL test microreactor funded by the United States Department of Energy (DOE) via the Microreactor Program (MRP). The goal of the project is to establish an operational nuclear applications test bed that can generate combined heat and power to enable integration and R&D with end-user technologies, as well as allow microreactor technologists to test next-generation control systems. The microreactor is a thermal reactor utilizing Uranium Zirconium Hydride (UZrH) fuel with review and authorization by the Department of Energy Idaho Operations Office (DOE-ID) for National Environmental Policy Act (NEPA) compliance, safety review, and supplemental readiness assessments for startup and operation. To enable rapid deployment, the MARVEL reactor will reside in the Transient Reactor Test (TREAT) Facility and utilize the existing operating Category B reactor facility, approved facility safety basis, operating crews, and recent re-start experience.

21 - SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLAN↗

Mechanical qualification of the support structure for MQXF, the Nb 3 Sn low-β quadrupole for the high luminosity LHC

Within the scope of the High Luminosity LHC project, the collaboration between CERN and U.S. LARP is developing new low-β quadrupoles using the Nb 3 Sn superconducting technology for the upgrade of the LHC interaction regions. The magnet support structure of the first short model was designed and two units were fabricated and tested at CERN and at LBNL. The structure provides the preload to the collars-coils subassembly by an arrangement of outer aluminum shells pre-tensioned with water-pressurized bladders. For the mechanical qualification of the structure and the assembly procedure, superconducting coils were replaced with solid aluminum “dummy coils”, the structure was preloaded at room temperature, and then cooled-down to 77 K. Mechanical behavior of the magnet structure was monitored with the use of strain gauges installed on the aluminum shells, the dummy coils and the axial preload system. As a result, this paper reports on the outcome of the assembly and the cool-down tests with dummy coils, which were performed at CERN and at LBNL, and presents the strain gauge measurements compared to the 3D finite element model predictions.

43 PARTICLE ACCELERATORS↗

Analysis of rapidly synthesized guest-filled porous complexes with synchrotron radiation: practical guidelines for the crystalline sponge method

This report describes complete practical guidelines and insights for the crystalline sponge method, which have been derived through the first use of synchrotron radiation on these systems, and includes a procedure for faster synthesis of the sponges. These guidelines will be applicable to crystal sponge data collected at synchrotrons or in-house facilities, and will allow researchers to obtain reliable high-quality data and construct chemically and physically sensible models for guest structural determination. A detailed set of synthetic and crystallographic guidelines for the crystalline sponge method based upon the analysis of expediently synthesized crystal sponges using third-generation synchrotron radiation are reported. The procedure for the synthesis of the zinc-based metal–organic framework used in initial crystal sponge reports has been modified to yield competent crystals in 3 days instead of 2 weeks. These crystal sponges were tested on some small molecules, with two being unexpectedly difficult cases for analysis with in-house diffractometers in regard to data quality and proper space-group determination. These issues were easily resolved by the use of synchrotron radiation using data-collection times of less than an hour. One of these guests induced a single-crystal-to-single-crystal transformation to create a larger unit cell with over 500 non-H atoms in the asymmetric unit. This led to a non-trivial refinement scenario that afforded the best Flack x absolute stereochemical determination parameter to date for these systems. The structures did not require the use of PLATON/SQUEEZE or other solvent-masking programs, and are the highest-quality crystalline sponge systems reported to date where the results are strongly supported by the data. A set of guidelines for the entire crystallographic process were developed through these studies. In particular, the refinement guidelines include strategies to refine the host framework, locate guests and determine occupancies, discussion of the proper use of geometric and anisotropic displacement parameter restraints and constraints, and whether to perform solvent squeezing/masking. The single-crystal-to-single-crystal transformation process for the crystal sponges is also discussed. The presented general guidelines will be invaluable for researchers interested in using the crystalline sponge method at in-house diffraction or synchrotron facilities, will facilitate the collection and analysis of reliable high-quality data, and will allow construction of chemically and physically sensible models for guest structural determination.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

MP1 Intermediate Characterization Report Summary

Great effort worldwide has been invested in replacing high enriched uranium (HEU) fuel with low enriched uranium (LEU) fuel in nuclear plants. This effort aims in safeguarding nuclear material and promoting the proliferation resistance of current reactors. The United States Department of Energy (DOE), National Nuclear Security Administration's (NNSA) Materials Management and Minimization Reactor Conversion program is actively working to convert civilian research and test reactors from the use of HEU to LEU fuel. To date, DOE NNSA has converted or verified the shutdown of various domestic reactors and also reactors worldwide. The task to develop and test a new LEU fuel while maintaining current performances has been assigned to the High-Performance Research Reactor (USHPRR) program. U alloyed with Mo achieves the goal of high uranium density necessary for the conversion of the high performance research reactors, and has also demonstrated good performance in pile [1]. The alloying process of U with Mo stabilizes the body-centered cubic (bcc) gamma phase (?-U) at room temperature. Without this alloying property enhancement, this phase is only stable at temperatures only above 770 °C. Retaining this isotropic gamma phase within the U-Mo alloy provides swelling and oxidation resistance and desired mechanical properties [2]. Generally 10% w. has been considered sufficient to achieve stabilization. However, local phenomena within the alloy can affect the local Mo content and lead to gamma phase decomposition. Because of this, it has been suggested that controlling gamma phase decomposition is most critical during processing [2-3]. The work detailed in this document is part of the HPPR program and focuses on the characterization of fresh fuel (a.k.a. as fabricated, before reactor testing) in collaboration with other laboratories including PNNL (Pacific Northwest National Laboratory), LANL (Los Alamos National Laboratory) and BWXT (Babcock and Wilcox Technologies). This testing is part of a 4 way validation for which similar samples from master plates were taken and distributed to each laboratory to independently analyze utilizing a standardized set of measurement and analysis procedures. When complete this work will supply a “toolbox” of information for alloying and fabrication parameters with its direct effects on microstructure quantified. Various parameters have been analyzed in this characterization effort (including grain size, quality of the coating layer, composition of the samples, carbide content etc.), based on the direction of the working group in ref.[4]. The final aim of this work is to increase the understanding of the impact of processing conditions on the final fuel microstructure, using fabrication processes that meet “commercial viability” requirements [4]. The strength of this campaign rests on the extent of the samples studied and the variation of the manufacture parameters which will permit to achieve the required understanding. Thus permitting to use these experiments to down-select test samples used to evaluate irradiation performance [4] to be tested in various locations of the Idaho National Laboratory (INL) Advanced Test Reactor (ATR).

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

Cask RT-100 Type B(U) Self-Certification for DOT 7A, Type A Nuclear Waste Transportation - 20098

The purpose of this Type A certification is to diversify the use of the RT-100 cask by allowing the end user to transport either Type A or Type B radioactive waste in accordance with the handling procedures for each waste category. The project's scope included the development of a matrix that contains all applicable requirements for a Type A package from the Code of Federal Regulations (CFR), Title 49 for the Department of Transportation (DOT) with a justification for each requirement. Moreover, the scope included the writing of conditions and restrictions list for the transportation of Type A nuclear waste, the writing of a compliance statement, and the design and fabrication of a Type A placard to be permanently placed on the RT-100 cask. Type A packages are self-certified by the end user using one of three methods as permitted by 49 CFR 173.461, either by performance of tests with prototypes or samples of the specimens representing the packaging, or reference to a previous satisfactory demonstration of compliance of a sufficiently similar nature, or calculations or reasoned evaluation using reliable and conservative procedures and parameters. Since the RT-100 cask was licensed by the Nuclear Regulatory Commission (NRC) as a Type B cask, Robatel relied on the method of reference to a previous satisfactory demonstration of compliance of a sufficiently similar nature for Type A certification. This method was determined to be acceptable, since Type B packages are evaluated for more demanding transport conditions than those required for Type A packages. This paper presents Robatel's process for certifying the RT-100 cask for Type A shipments, an overview of the DOT regulations related to Type A packages, and the documents that were generated for the end user. This paper is concluded with a discussion on the advantages of having the option to transport both Type A and Type B nuclear waste, and possible future projects to further improve the operation of the cask when making Type A shipments. (authors)

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗

Energy and momentum preserving Coulomb collision model for kinetic Monte Carlo simulations of plasma steady states in toroidal fusion devices

A kinetic Monte Carlo model suited for self-consistent transport studies is proposed and tested. The Monte Carlo collision operator is based on a widely used model of Coulomb scattering by a drifting Maxwellian and a new algorithm enforcing the momentum and energy conservation laws. The difference to other approaches consists in a specific procedure of calculating the background Maxwellian parameters, which does not require ensemble averaging and, therefore, allows for the use of single-particle algorithms. This possibility is useful in transport balance (steady state) problems with a phenomenological diffusive ansatz for the turbulent transport, because it allows a direct use of variance reduction methods well suited for single particle algorithms. In addition, a method for the self-consistent calculation of the electric field is discussed. Results of testing of the new collision operator using a set of 1D examples, and preliminary results of 2D modelling in realistic tokamak geometry, are presented.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Beam Commissioning Results from the CBETA Fractional Arc Test (CBETA Note 030)

This work describes first commissioning results from the Cornell Brookhaven ERL Test Accelerator fractional arc test. These include the recommissioning of the Cornell photoinjector, the first full energy operation of the main linac with beam, as well as commissioning of the lowest energy matching beamline (splitter) and a partial section of the Fixed Field Alternating gradient (FFA) return loop featuring first production Halbach style permanent magnets. Achieving these tasks required characterization of the injection beam, calibration and phasing of the main linac cavities, demonstration of the required 36 MeV energy gain, and measurement of the splitter line horizontal dispersion and R 56 at the nominal 42 MeV. In addition, a procedure for determining the BPM offsets, as well as the tune per cell in the FFA section via scanning the linac energy and inducing betatron oscillations around the periodic orbit in the fractional arc was developed and tested. A detailed comparison of these measurements to simulation is discussed.

43 PARTICLE ACCELERATORS↗

A test on reactive force fields for the study of silica dimerization reactions

We studied silica dimerization reactions in the gas and aqueous phase by density functional theory (DFT) and reactive force fields based on two parameterizations of ReaxFF. For each method (both ReaxFF force fields and DFT), we performed constrained geometry optimizations, which were subsequently evaluated in single point energy calculations using the other two methods. Standard fitting procedures typically compare the force field energies and geometries with those from quantum mechanical data after a geometry optimization. The initial configurations for the force field optimization are usually the minimum energy structures of the ab initio database. Hence, the ab initio method dictates which structures are being examined and force field parameters are being adjusted in order to minimize the differences with the ab initio data. As a result, this approach will not exclude the possibility that the force field predicts stable geometries or low transition states which are realistically very high in energy and, therefore, never considered by the ab initio method. Our analysis reveals the existence of such unphysical geometries even at unreactive conditions where the distance between the reactants is large. To test the effect of these discrepancies, we launched molecular dynamics simulations using DFT and ReaxFF and observed spurious reactions for both ReaxFF force fields. Our results suggest that the standard procedures for parameter fitting need to be improved by a mutual comparative method.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Modeling of Environmental-Economic Indicators of Regional Development

One of the current topical problems is the prediction of climate change and mitigation of its consequences. All-sided analysis of ecological, economic, and social aspects of climate issues relies on interdisciplinary assessment models. This article adapts the MERGE optimization model to the current state of the world economy and introduces into the model a new component that implements a simplified procedure of “green” GDP calculation (“green” GDP, or GGDP, provides information about the efficiency of use of environmental resources). The objective of our numerical simulations is to tests the consequences of Russia’s hypothetical participation in the program for reducing greenhouse gas (GHG) emissions and to analyze the environmental indicators of Russia’s GDP. The input data are mainly provided by the project of scenario conditions and main macroeconomic parameters for the forecasting of socio-economic development in Russia in the near future implemented by the Ministry of Economic Development of the Russian Federation. The calculations reveal the existence of reserves for Russia’s “painless” participation in environment-preserving initiatives that call for not exceeding the 1990 emission level in 2020–2025. At the same time, increasing the environmental efficiency of Russia’s GDP is a relevant task that requires immediate attention.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗

Finite element model for piles in liquefiable ground

This paper develops a three dimensional finite element modelling method for piles in liquefiable ground and applies it to the analysis of seismic pile responses. A unified plasticity model for large post-liquefaction shear deformation of sand provides the basis for the effective and efficient modelling of liquefiable ground. Special attention is dedicated towards the modelling of piles and soil-pile interface to accurately reflect the behaviour of piles. A staged modelling procedure is adopted to appropriately generate the initial conditions for the soil and piles and achieve hydrostatic pore pressure prior to seismic loading. Three centrifuge shaking table tests on single piles, both with and without pile cap and superstructure, in level and inclined liquefiable ground are conducted and simulated in validation and application of the proposed method. Further studies to investigate the effects of pile cap, lateral spreading, and non-liquefiable surface layer are undertaken numerically using the validated method. The results show these aforementioned factors to be influential in the dynamic and residual response of piles in liquefiable ground.

Centrifuge test↗