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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 559 records · Page 31

The Role of Ir in Ternary Rh-Based Catalysts for Syngas Conversion to C2+ Oxygenates

Transition metal modified Rh-catalysts can be used for converting syngas (CO+H2) into C2+ oxygenates. It has been found that Mn has a favorable effect in the selectivity towards oxygenates, while addition of Ir to the binary Rh-Mn catalysts significantly increases the space-time yield of C2+ oxygenates. In this paper, we use quantum mechanical calculations to investigate the distribution of promoter sites within Rh rich nanoparticles and their role in the conversion of syngas towards ethanol. This work was supported by the U.S. Department of Energy (DOE), Office of Energy Efficiency and Renewable Energy Biomass Program. The Pacific Northwest National Laboratory (PNNL) is operated by Battelle for the DOE under Contract DE-AC05-76RL01830. A portion of the research was performed in the Environmental Molecular Sciences Laboratory (EMSL), a national science user facility sponsored by the Department of Energy’s Office of Biological and Environmental Research located at PNNL.

DFT models↗

Environmental Remediation Science at Beamline X26A at the National Synchrotron Light Source- Final Report

The goal of this project was to provide support for an advanced X-ray microspectroscopy facility at the National Synchrotron Light Source, Brookhaven National Laboratory. This facility is operated by the University of Chicago and the University of Kentucky. The facility is available to researchers at both institutions as well as researchers around the globe through the general user program. This facility was successfully supported during the project period. It provided access to advanced X-ray microanalysis techniques which lead to fundamental advances in understanding the behavior of contaminants and geochemistry that is applicable to environmental remediation of DOE legacy sites as well as contaminated sites around the United States and beyond.

54 ENVIRONMENTAL SCIENCES↗

FY23 Status Report of the Activated Materials Laboratory at the Advanced Photon Source

The Activated Materials Laboratory (AML) is a new radiological facility located at the Advanced Photon Source (APS) in Argonne National Laboratory (ANL), adjacent to the high-energy x-ray microscopy (HEXM) beamline in the long beamline building (LBB) constructed under the APS-upgrade (APS-U) project. The AML is a centralized facility to facilitate the safe conduct of experiments on activated materials at the APS. This report provides an overview of the status of the AML as a Nuclear Science User Facilities (NSUF) partner user facility in preparation for the general user access in 2024 upon the commissioning of the APS-U beamlines. Specifically, details are provided regarding the laboratory's scope, functionality, components, operational blueprint, and data management approach. The plans on augmenting the instrumentation, refining operational procedures and developing a robust data management strategy for FY24 and beyond are also discussed.

43 PARTICLE ACCELERATORS↗

Development of Transformative Preparation Methods to Push up High Q&G Performance of FRIB Spare HWR Cryomodule Cavities

The FRIB accelerator project construction, a top priority of US nuclear science, was completed in January 2022, and is now moving to user operation. The stable and reliable operation of the accelerating cryomodules is essential in achieving/fulfilling DOE and user expectations. So far, FRIB cryomodules meet all FRIB specifications for cavity performance. However, during the lifetime of machine operation, degradation of cryomodule performance is possible, as reported in similar operating facilities (CEBAF, SNS). If cryomodule degradation is observed at FRIB, the under-performing cryomodule will require replacement/maintenance. In effort to manage operational reliability, FRIB plans to construct a 0.53 half-wave cryomodule to serve as an active spare. In a parallel effort, FRIB will also work toward increasing operational Q and gradient of spare cryomodule cavities to gain an overall performance margin to support future operational reliability. The current FRIB cavity designs have a potential to operate at gradients higher than 8 MV/m, but are currently limited by field emission (FE) and/or high field Q slope (HFQS); known issue in buffered chemical polished (BCP) treated cavities. The proposal looks to develop transformative surface preparation treatments to improve the operational gradient of spare cryomodules higher than 10 MV/m while maintaining high Q. Thus, increasing operational margin by 30 - 50%. With the goal to improve operational reliability set, the proposal will investigate multiple objectives as possible paths forward to achieve an overall increase in cavity performance and gain a better understanding of SRF limiting mechanisms. The proposal will study the application of different chemical surface treatments to 0.53 half-wave cavities, with the addition of low temperature bakes (LTB), and measure their effects on accelerating performance. Proposed chemical treatments to be explored in this proposal include conventional EP acid mixtures, as well as innovated EP and BCP acid mixtures designed to simplify processing paths in migrating FE and HFQS. The proposed transformative treatment wet N-doping also has the potential to replicate recent advancements in SRF technology relating to nitrogen doping and high Q operation without the requirement for an ultra-high vacuum annealing furnace; currently being developed at FNAL and JLAB. In parallel, high Q performance relating to flux trapping will be investigated with the installation of a second layer of magnetic shielding in the vertical test Dewar. The research objectives presented in the proposal, and their corresponding effects on cavity performance, will provide essential knowledge and future guidance to the SRF community and provide possible paths for future SRF based projects and applications.

43 PARTICLE ACCELERATORS↗

Development of a Thermal Vacuum Chamber for Lunar Surface Simulation

Simulating the lunar surface environment is a critical component in advancing the Technology Readiness Level (TRL) of newly developed lunar surface exploration systems and understanding regolith dynamics. Developing systems with the ability to simulate the lunar surface environment presents unique challenges associated with both the hardware requirements of the system and the uniqueness of the lunar environment. Additionally, many thermal vacuum testing systems are large and expensive to maintain and operate, increasing the cost for the end users. Many low TRL prototypes are small-scale and low-cost, making it unfeasible and unnecessary to utilize larger scale testing facilities. A small-scale, modular, and easily reconfigurable chamber with a quick testing turnaround time could allow rapid TRL advancement with minimal costs and time commitments relative to many of the current testing facilities. Here, we introduce a thermal vacuum chamber system that will support experimentation and rapid testing and maturation of small-scale hardware systems and subsystems for lunar surface exploration.

Thermal Vacuum Chamber↗

Development of Magnesium Diboride Superconducting Coils for Nuclear Physics Application

The primary objective of this project is to develop an affordable magnet technology at 10-25K and then take it to a level that it can be considered mature enough to be used in a real Nuclear Physics accelerator system. We believe that because of the lower cost of magnesium diboride (MgB2) as compared to the other HTS, it offers the best such chance. Once successfully demonstrated, this exciting and innovative technology could potentially revolutionize the field the same way the conventional superconducting NbTi magnets did several decades ago. MgB2 magnets could reduce the cost of ownership (capital +operation) while enhancing performance. Another innovation is the overall cooling scheme where the exhaust gas of an existing superconducting magnet cools the inner tube which conduction cools the MgB2 coils. In several instances during the upgrade of existing facilities or designing new facilities in the Nuclear Physics or High Energy Physics communities, it is found that magnets made neither with copper coils nor with conventional superconducting NbTi coils offer an acceptable solution. Whereas copper coils limit the performance of the machine and consume large amount of power, NbTi require 4 K cryogenic facilities. This is particularly applicable in those Nuclear Physics machines where the magnetic field requirements are rather modest. One such case has been found in the Relativistic Heavy Ion Collider (RHIC) at Brookhaven National Laboratory (BNL) where an e-lens system is under construction to increase RHIC luminosity. In this case, magnesium diboride (MgB2) operating at 10-25 K seems to offer an exciting and practical solution. The main objective in Phase II is to demonstrate the reliability and robustness of the MgB2 coil technology, so that it is ready for use in RHIC and other user facilities. We will do this by fabricating several MgB2 coils and by conducting an exhaustive series of lifetime cycle tests. The tests will involve about a thousand ramp-up and ramp-down cycles, about 20 over current or thermal-excursions hitting the quench limit and about 10 thermal cycles. Phase II will begin with a design modeling effort of the MgB2 coils for the e-lens system with enough detail so that the magnetic, thermal and stress requirements can be understood for the fabrication and testing of representative MgB2 coils. After the technology is proven in Phase II for reliability, we will propose to use this in Phase III to upgrade RHIC e-lens system for improved luminosity performance and expect that more applications will follow in other accelerator and medical facilities.

99 GENERAL AND MISCELLANEOUS↗

Architectural considerations for recirculated and energy recovered hard XFEL drivers

A confluence of events motivates discussion of design options for hard XFEL driver accelerators. Firstly, multiple superconducting radio-frequency (SRF) driven systems are now online (European XFEL), in construction (LCLS-II), or in design (MARIE); these provide increasing evidence of the transformational potential they offer for fundamental science with its concomitant benefits. Secondly, operation of 12 GeV CEBAF* validates use of recirculation in high energy SRF linacs. Thirdly, advances in the analysis and control of effects such as coherent synchrotron radiation (CSR) and the microbunching instability (uBI) have been recently achieved. Collectively, these developments offer insights providing extended facility science reach, reduced costs, multiplicity (i.e., support of numerous FELs operating over a range of wavelengths), and enhanced scalability and upgradability (to higher powers and energies). We will discuss the relationship amongst the various threads, and indicate how they inform design choices for the system architecture of an option for the UK-XFEL** - that of a staged multi-user X-ray FEL and nuclear physics facility based on a multi-pass recirculating SRF CW linac.

Benson, Stephen V.↗

Automated management of radioactive sources in Saudi Arabia

For usage of radioactive substances, any facility has to register and take license from relevant authority of the country in which such facility is operating. In the Kingdom of Saudi Arabia (KSA), the authority for managing radioactive sources and providing licenses to organizations for its usage is the National Center of Radiation Protection (NCRP). This paper describes the system that automates registration and licensing process of the National Center of Radiation Protection. To provide 24×7 accesses to all the customers of NCRP, system is developed as web-based application that provide facility to online register, request license, renew license, check request status, view historical data and reports etc. and other features are provided as Electronic Services that would be accessible to users via internet. The system also was designed to streamline and optimize internal operations of NCRP besides providing ease of access to its customers by implementing a defined workflow through which every registration and license request will be routed. In addition to manual payment option, the system would also be integrated with SADAD (online payment system) that will avoid lengthy and cumbersome procedures associated with manual payment mechanism. Using SADAD payment option license fee could be paid through internet/ATM machine or branch of any designated bank, Payment will be instantly notified to NCRP hence delay in funds transfer and verification of invoice could be avoided, SADAD integration is discussed later in the document.

07 ISOTOPE AND RADIATION SOURCES↗

The EBIT Calorimeter Spectrometer: A New, Permanent User Facility at the LLNL EBIT

The EBIT Calorimeter Spectrometer (ECS) has recently been completed and is currently being installed at the EBIT facility at the Lawrence Livermore National Laboratory. The ECS will replace the smaller XRS/EBIT spectrometer that has been in almost continuous operation since 2000. The XRS/EBIT was based on a spare laboratory cryostat and an engineering model detector system from the Suzaku/XRS observatory. The new ECS spectrometer was built from the ground up to be a low maintenance, high performance microcalorimeter spectrometer with 4 eV resolution at 6 keV, 32 detector channels, 10 us event timing, and capable of uninterrupted acquisition sessions of over 70 hours at 50 mK. The XRSIEBIT program has been extremely successful, producing over two-dozen refereed publications on topics such as laboratory astrophysics, atomic physics, nuclear physics, and calibration of the spectrometers for the National Ignition Facility, with many more publications in preparation. The ECS spectrometer will continue this work into the future with improved spectral resolution, integration times, and ease-of-use. We designed the ECS instrument with TES detectors in mind by using the same highly successful magnetic shielding as our laboratory TES cryostats. This design will lead to a future TES instrument at the LLNL EBIT. This proposed future instrument would include a hybrid detector system with 0.8 eV resolution in the band from 0.1-1.0 keV, 2 eV from 0.1-10 keV, and 30 eV from 0.5-100 keV, with high quantum efficiency in each band. Here we discuss the legacy of the XRS/EBIT program, the performance of the new ECS spectrometer, and plans for a future TES spectrometer.

Porter, S.↗

Collaborative Host Facility for Lunar Operations

This project establishes a new collaborative simulation connectivity capability for JSC utilizing existing facilities. The principal collaborating organizations are Safety & Mission Assurance (Code NA) and Engineering Directorate (Code EA), but the capability is open for any JSC user. The core of the connectivity resides in Code ER7’s Concept Exploration Laboratory (CEL) and is part of ER7’s Systems Engineering Simulator (SES) complex. NA Subject Matter Experts (SMEs) work proactively in situ with EA and commercial crew counterparts to evaluate Safety Review Panel (SRP) protocols for landers, habitation modules, and lunar roving systems using the same tools, terrain models and data as the designers. NA software initiated under two JSC Center Innovation Fund (CIF) and Innovation Charge account (ICA) funded projects will be used to configure the CEL to function as an EA maintained facility. Collaboration via the CEL with the U.S. Space Force (USSF) provides visibility for USSF. The potential for commercial crew and vehicle suppliers will require IT security and associated security architecture to be implemented in additional CIF based proposals.

Collaborative Simulation Hosting↗

Online remote control systems for static and dynamic compression and decompression using diamond anvil cells

The ability to remotely control pressure in diamond anvil cells (DACs) in accurate and consistent manner at room temperature, and at cryogenic and elevated temperatures, is crucial for effective and reliable operation of a high-pressure synchrotron facility such as High Pressure Collaborative Access Team (HPCAT). Over the last several years, a considerable effort has been made to develop instrumentation for remote and automated pressure control in DACs during synchrotron experiments. We have designed and implemented an array of modular pneumatic (double-diaphragm), mechanical (gearboxes), and piezoelectric devices and their combinations for controlling pressure and compression/decompression rate at various temperature conditions from 4 K in cryostats to several thousand Kelvin in laser-heated DACs. Because HPCAT is a user facility and diamond cells for user experiments are typically provided by users, our development effort has been focused on creating different loading mechanisms and frames for a variety of existing and commonly used diamond cells rather than designing specialized or dedicated diamond cells with various drives. In this paper, we review the available instrumentation for remote static and dynamic pressure control in DACs and show some examples of their applications to high pressure research.

47 OTHER INSTRUMENTATION↗

Characterization of oxygen and titanium diffusion at the anatase TiO2(001) surface

The diffusion of intrinsic defects in a single crystal anatase TiO2(001) film was explored by isotopic labeling and static secondary ion mass spectrometry. Using both 46Ti and 18O as isotopic labels, we show that the anatase surface responds to redox imbalances by diffusion of both Ti and O into the bulk under vacuum reduction and (at least) Ti from the bulk to the surface during oxidation. The diffusion of Ti between the bulk and surface in anatase TiO2(001) closely resembles what was observed in the literature for the rutile TiO2(110) surface, however the latter is not known to have oxygen diffusion between the bulk and surface under typical ultrahigh vacuum conditions. We speculate that the open lattice of the anatase bulk structure may facilitate independent diffusion of both point defects (Ti interstitials and O vacancies) or concerted diffusion of "TiO" subunits. The authors gratefully acknowledge S.A. Chambers of Pacific Northwest National Laboratory (PNNL) for providing the anatase samples. This research was supported by the U.S. Department of Energy (DOE) Office of Basic Energy Sciences, Chemical Sciences, Geosciences, and Biosciences Division, the Office of Naval Research Contract Number 200CAR262, and the Oregon Nanoscience and Microtechnologies Institute. PNNL is operated for the U.S. DOE by Battelle under Contract Number DE05-AC76RL0 1830. The research was performed in the William R. Wiley Environmental Molecular Sciences Laboratory, a national scientific user facility funded by the U.S. DOE Office of Biological and Environmental Research.

Herman, Gregory S.↗

APS SCIENCE 2016

The Advanced Photon Source (APS) occupies an 80-acre site on the Argonne national laboratory campus, about 25 miles from downtown chicago, illinois. it shares the site with the center for nanoscale materials and the Advanced Protein characterization facility. for directions to Argonne, see http://www.anl.gov/directions-and-visitor-information. The APS, a national synchrotron radiation research facility operated by Argonne for the u.S. department of energy (doe) office of Science, provides this nation’s brightest high-energy x-ray beams for science. research by APS users extends from the center of the earth to outer space, from new information on combustion engines and microcircuits to new drugs and nanotechnologies whose scale is measured in billionths of a meter. The APS helps researchers illuminate answers to the challenges of our high-tech world, from developing new forms of energy, to sustaining our nation’s technological and economic competitiveness, to pushing back against the ravages of disease. research at the APS promises to have far-reaching

99 GENERAL AND MISCELLANEOUS↗

A Summary of HDM

A brief summary of the Hierarchical Development Methodology (HDM) is provided. The design of a system is decomposed into a hierarchy of abstract machines, linearly ordered with a different abstract machine at each level in the hierarchy. Each abstract machine in the hierarchy is dependent only on the functionality of lower level machines. The facilities of the highest level abstract machine, and only those of that machine, are visible to a user of the system. A machine is itself decomposed into modules, each module having operations and data structures which typically define a single abstract data concept. As in the Parnas module concept, the module is the programming unit of HDM; each of the modules may be independently implemented. The programs implementing a module can access the data structures of their own abstract machine, but not those of lower level machines.

Source record↗

Volume serving and media management in a networked, distributed client/server environment

The E-Systems Modular Automated Storage System (EMASS) is a family of hierarchical mass storage systems providing complete storage/'file space' management. The EMASS volume server provides the flexibility to work with different clients (file servers), different platforms, and different archives with a 'mix and match' capability. The EMASS design considers all file management programs as clients of the volume server system. System storage capacities are tailored to customer needs ranging from small data centers to large central libraries serving multiple users simultaneously. All EMASS hardware is commercial off the shelf (COTS), selected to provide the performance and reliability needed in current and future mass storage solutions. All interfaces use standard commercial protocols and networks suitable to service multiple hosts. EMASS is designed to efficiently store and retrieve in excess of 10,000 terabytes of data. Current clients include CRAY's YMP Model E based Data Migration Facility (DMF), IBM's RS/6000 based Unitree, and CONVEX based EMASS File Server software. The VolSer software provides the capability to accept client or graphical user interface (GUI) commands from the operator's console and translate them to the commands needed to control any configured archive. The VolSer system offers advanced features to enhance media handling and particularly media mounting such as: automated media migration, preferred media placement, drive load leveling, registered MediaClass groupings, and drive pooling.

Herring, Ralph H.↗

Data Center High-Temperature Liquid Cooling and Heat Reuse Techno-Economic Study: Preprint

Data centers are energy-intensive facilities with growing demands for efficiency and cost-effective operations. Smaller, more distributed edge inference data centers are expected to proliferate as AI applications require low latency closer to the user of AI tools, which presents a growing opportunity to explore the systems implications of liquid cooling on water and energy use. This study analyzes the implementation of high-temperature liquid cooling systems in a prototypical inference 1-MW data center and explores the potential for heat reuse across varying climates with a goal to optimize energy efficiency, reduce capital and operational costs, and identify opportunities for high-performance cooling and water use reduction infrastructure. This analysis evaluated configurations utilizing a peak day hourly sizing and systems performance spreadsheet to evaluate design and operational conditions from which component sizes, installed cost, operational cost, and performance metrics were determined for the Base case and the Elevated case. The techno-economic analysis included heat reuse applications across a range of heat recovery temperatures and heat rejection options. The analysis shows that high-temperature liquid cooling allows for improved energy efficiency, lower water consumption, and lower capital costs compared to traditional cooling approaches. Transitioning to elevated water inlet/outlet temperatures (50 degrees C/60 degrees C) eliminates the need for chillers, cooling towers, and heat recovery equipment in many scenarios across three distinct climate zones. This results in up to 75% capital cost savings for the cooling and heat recovery equipment, and with significantly reduced water consumption, especially in non-heat reuse applications. Heat generated from data centers can also be repurposed for space heating, domestic hot water, and other applications, and is most cost-effective when data center outlet temperatures exceed 55-60 degrees C.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗