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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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All sourcesNASA NTRSDOE OSTI
DOE OSTI2019

Data-driven glass/ceramic science research: Insights from the glass and ceramic and data science/informatics communities

Data-driven science and technology have helped achieve meaningful results in areas such as materials/drug discovery and health care, but efforts to apply high-end data science algorithms to the areas of glass and ceramics are still limited. Many glass and ceramic researchers are interested in enhancing their work by using more data and data analytics to efficiently develop better functional materials. Simultaneously, the data science community is looking for a way to access materials data resources to test and validate their advanced computational learning algorithms. To bring together the glass/ceramic and data science communities to address this issue, The American Ceramic Society (ACerS) convened a Glass/Ceramics Data Science Workshop on February 6, 2018, at Nexight Group offices in Silver Spring, Maryland. The workshop, sponsored by the National Institute for Standards and Technology (NIST) Advanced Manufacturing Technologies (AMTech) program, brought together a select group of 20 key leaders in the data science, informatics, and glass/ceramics communities to identify the greatest opportunities and mechanisms for facilitating increased collaboration and coordination between these communities. This article summarizes workshop discussions about the current challenges that limit interactions and collaboration between the glass/ceramic and data science communities, opportunities for a coordinated approach that leverages existing knowledge in both communities, and a clear path toward the enhanced use of data science technologies for functional glass and ceramic research and development.

data science, ceramics, informatics↗
DOE OSTI2012

A combinatorial histidine scanning library approach to engineer highly pH-dependent protein switches

There is growing interest in the development of protein switches, which are proteins whose function, such as binding a target molecule, can be modulated through environmental triggers. Efforts to engineer highly pH sensitive protein-protein interactions typically rely on the rational introduction of ionizable groups in the protein interface. Such experiments are typically time intensive and often sacrifice the protein's affinity at the permissive pH. The underlying thermodynamics of proton-linkage dictate that the presence of multiple ionizable groups, which undergo a pK{sub a} change on protein binding, are necessary to result in highly pH-dependent binding. To test this hypothesis, a novel combinatorial histidine library was developed where every possible combination of histidine and wild-type residue is sampled throughout the interface of a model anti-RNase A single domain VHH antibody. Antibodies were coselected for high-affinity binding and pH-sensitivity using an in vitro, dual-function selection strategy. The resulting antibodies retained near wild-type affinity yet became highly sensitive to small decreases in pH, drastically decreasing their binding affinity, due to the incorporation of multiple histidine groups. Several trends were observed, such as histidine 'hot-spots,' which will help enhance the development of pH switch proteins as well as increase our understanding of the role of ionizable residues in protein interfaces. Overall, the combinatorial approach is rapid, general, and robust and should be capable of producing highly pH-sensitive protein affinity reagents for a number of different applications.

59 BASIC BIOLOGICAL SCIENCES↗
DOE OSTI2024

Hyperbolic vacua in Minkowski space

Families of Lorentz, but not Poincare, invariant vacua are constructed for a massless scalar field in 4D Minkowski space. These are generalizations of the Rindler vacuum with a larger symmetry group. Explicit expressions are given as squeezed excitations of the Poincare vacuum. The effective reduced vacua on the 3D hyperbolic de Sitter slices are the well-known de Sitter α-vacua with antipodal singularities in the Wightman function. Several special interesting cases are discussed.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2018

Identification and characterization of circular RNAs in rapid atrial pacing dog atrial tissue

Highlights: • Revealed the expression characterization of circRNAs in dog atrial tissue. • Compared differentially expressed circRNAs between atrial fibrillation and control dog. • Found extensive interaction among circRNAs and AF related miRNAs and mRNAs. Circular RNAs (circRNAs) have emerged as novel molecules of interest in gene regulation as other noncoding RNAs, and participating in the process of many diseases. However, the expression and functions of circRNAs in Rapid atrial pacing (RAP) dog atrial tissue still unknown. 12 canines were randomly assigned to control and pacing group. RAP at 500 beats per minute was maintained 14 days in the pacing group. The expression characterization of circRNAs were revealed by high-throughput sequencing. We totally predicted 15,990 circRNAs in dog atrial tissues. Moreover, we found 146 differentially expressed circRNAs between control and RAP dogs. Five circRNAs were selected for subsequent RT-PCR validation, and four circRNAs confirmed with the high throughput sequencing analysis. GO analysis showed that the differentially expressed circRNAs might involve in the process of “structural constituent of cytoskeleton, ion channel activity”. We explored the circRNA-miRNA interaction network, and found extensive interaction among differentially expressed circRNAs and AF related miRNAs and mRNAs. Our work firstly identified the characterization of circRNAs in the dog atrial, and revealed the differentially expressed circRNAs in the RAP dog, this might lay a solid foundation on the function of circRNA in the mechanisms of AF.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2015

Bi–Mn mixed metal organic oxide: A novel 3d-6p mixed metal coordination network

A new terminology of metal organic oxide (MOO) was given a definition as a type of coordination polymers which possess the feature of inorganic connectivity between metals and the direct bonded atoms and show 1D, 2D or 3D inorganic sub-networks. One such compound was shown as an example. A 3d-6p (Mn–Bi. Named MOOMnBi) mixed metals coordination network has been synthesized via hydrothermal method. The new compound with the molecular formula of [MnBi{sub 2}O(1,3,5-BTC){sub 2}]{sub n} (1,3,5-BTC stands for benzene-1,3,5-tricarboxylate) was characterized via single crystal X-ray diffraction technique that revealed a very interesting 3-dimensional (3D) framework with Bi{sub 4}O{sub 2}(COO){sub 12} clusters which are further connected to Mn(COO){sub 6} fragments into a 2D MOO. The topology study indicates an unprecedented topological type with the net point group of (4{sup 13}.6{sup 2})(4{sup 13}.6{sup 8})(4{sup 16}.6{sup 5})(4{sup 18}.6{sup 10})(4{sup 22}.6{sup 14})(4{sup 3}) corresponding to 3,6,7,7,8,9-c hexa-nodal net. MOOMnBi shows catalytic activity in the synthesis of (E)-α,β-unsaturated ketones. - Graphical abstract: This metal organic framework (MOF) is the essence of a 2D metal organic oxide (MOO). - Highlights: • New concept of metal organic oxide (MOO) was defined and made difference from metal organic framework. • New MOO of MOOMnBi was synthesized by hydrothermal method. • Crystal structure of MOOMnBi was determined by single crystal X-ray analysis. • The catalytic activity of MOOMnBi was studied showing reusable after 2 cycles.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2020

Multiple Dirac nodes and symmetry protected Dirac nodal line in orthorhombic α-RhSi

Exotic multifold topological excitations have been predicted and were recently observed in transition metal silicides like β-RhSi. Herein, we report that interesting topological features of RhSi are also observed in its orthorhombic α phase, which displays multiple types of Dirac nodes very close to the Fermi level ε F . Here, we discuss the symmetry analysis, band connectivity along high-symmetry lines using group representations, band structure, the nature of the Dirac points and of a nodal line occurring near ε F which is protected by the crystalline symmetry. The de Haas–van Alphen effect indicates a Fermi surface in agreement with the calculations. We find an elliptically shaped nodal line very close to ε F around and near the S point on the k y -k z plane that results from the intersection of two upside-down Dirac cones. Both Dirac points of the participating Kramers degenerate bands are only 5 meV apart; hence, an accessible magnetic field might induce a crossing between the spin-up partner of the upper Dirac cone and the spin-down partner of the lower Dirac cone, possibly explaining the anomalies observed in the magnetic torque. α-RhSi is a unique system since all bands crossing ε F emerge from Dirac nodes.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2025

Postdoctoral insights on mentoring excellence: a framework for best practices at Sandia National labs

The Sandia National Laboratories Strategic Plan FY24-FY27, updated for FY25, outlines Sandia’s two Big Labs-wide Goals, Accelerate Innovation and Lead in Modern Engineering. The goal of Accelerate Innovation is that “by FY27, Sandia will be a leader in scientific, engineering and operational innovation and an employer of choice for highly innovative and creative talent.” Sandia’s postdocs are leaders in innovation, well-versed in emerging techniques and cutting-edge methods, and capable of acting as a highly agile technical force across domains at the lab. As a federally funded research and development center (FFRDC), Sandia National Laboratories attracts top doctoral talent by offering a unique opportunity for postdoctoral researchers to develop at the crossroads of government, academia, and industry, working in multi-disciplinary teams and performing cutting-edge, mission-specific research that responds to immediate needs of national interest. However, this creates unique opportunities and demands of both postdoctoral appointees and the Sandia staff who act as their mentors, making mentorship key to attract talent. Since 2007 the Sandia Postdoctoral Development (SPD) Board, originally Postdoc To Professional (PD2P), a networking group at Sandia composed of a voluntary board of current postdocs and two staff liaisons, has advocated for postdoctoral development within Sandia National Labs. In this white paper, SPD board members and the Sandia Postdoctoral Development Office, organized in 2019, have come together to develop a comprehensive overview of the postdoctoral mentoring landscape at Sandia National Labs as we currently know it. By scouring various forms of data from efforts since 2018, we’ve compiled a community-derived perspective on what makes postdoctoral mentorship at Sandia unique. First, we analyze working sessions held between mentors and mentees to develop a comprehensive map of who is involved in postdoctoral mentorship at the lab and how the responsibilities are divided amongst mentors and mentees. We then combine multiple forms of data, including exit surveys, annual surveys, and community workshops, to identify the specific challenges that mentors and mentees encounter at the national lab. Finally, we use text mining and sentiment analysis to analyze mentoring award data to develop an idea of what postdocs are self-identifying as excellent mentorship within the lab. It is our goal that this white paper act as an ongoing resource to the postdoc and postdoc mentoring communities and provide a firm foundation for further conversations on the future of postdoctoral mentorship at Sandia National Labs.

99 GENERAL AND MISCELLANEOUS↗
DOE OSTI2019

Fischer-Tropsch Synthesis: Cd, In and Sn Effects on a 15%Co/Al 2 O 3 Catalyst

The effects of 1% of Cd, In and Sn additives on the physicochemical properties and Fischer-Tropsch synthesis (FTS) performance of a 15% Co/Al 2 O 3 catalyst were investigated. The fresh and spent catalysts were characterized by BET, temperature programmed reduction (TPR), H 2 -chemisorption, NH 3 temperature programmed desorption (TPD), X-ray absorption near edge spectroscopy (XANES), and X ray diffraction (XRD). The catalysts were tested in a 1 L continuously stirred tank reactor (CSTR) at 220 °C, 2.2 MPa, H 2 /CO = 2.1 and 20–55% CO conversion. Addition of 1% of Cd or In enhanced the reduction degree of 15%Co/Al 2 O 3 by ~20%, while addition of 1% Sn slightly hindered it. All three additives adversely impacted Co dispersion by 22–32% by increasing apparent Co cluster size based on the H 2 -chemisorption measurements. However, the decreased Co active site density resulting from the additives did not result in a corresponding activity loss; instead, the additives decreased the activity of the Co catalysts to a much greater extent than expected, i.e., 82–93%. The additional detrimental effect on catalyst activity likely indicates that the Cd, In and Sn additives migrated to and covered active sites during reaction and/or provided an electronic effect. XANES results showed that oxides of the additives were present during the reaction, but that a fraction of metal was also likely present based on the TPR and reaction testing results. This is in contrast to typical promoters that become metallic at or below ~350 °C, such as noble metal promoters (e.g., Pt, Ru) and Group 11 promoters (e.g., Ag, Au) on Co catalysts in earlier studies. In the current work, all three additives remarkably increased CH 4 and CO 2 selectivities and decreased C 5+ selectivity, with the Sn and In additives having a greater effect. Interestingly, the Cd, In, or Sn additives were found to influence hydrogenation and isomerization activities. At a similar conversion level (i.e., in the range of 40–50%), the additives significantly increased 2-C 4 olefin content from 3.8 to 10.6% and n-C 4 paraffin from 50 to 61% accompanied by decreases in 1-C 4 olefin content from 48 to 30%. The Sn contributed the greatest impact on the secondary reactions of 1-olefins, followed by the In and Cd. NH 3 -TPD results suggest enhanced acid sites on cobalt catalysts resulting from the additives, which likely explains the change in selectivities for the different catalysts.

36 MATERIALS SCIENCE↗
NASA NTRS1980

Seasat views North America, the Caribbean, and Western Europe with imaging radar

Forty-one digitally correlated Seasat synthetic-aperture radar images of land areas in North America, the Caribbean, and Western Europe are presented to demonstrate this microwave orbital imagery. The characteristics of the radar images, the types of information that can be extracted from them, and certain of their inherent distortions are briefly described. Each atlas scene covers an area of 90 X 90 kilometers, with the exception of the one that is the Nation's Capital. The scenes are grouped according to salient features of geology, hydrology and water resources, urban landcover, or agriculture. Each radar image is accompanied by a corresponding image in the optical or near-infrared range, or by a simple sketch map to illustrate features of interest. Characteristics of the Seasat radar imaging system are outlined.

Ford, J. P.↗
NASA NTRS1990

Proceedings of the LDEF Materials Data Analysis Workshop

The 5-year, 10-month flight of the Long Duration Exposure Facility (LDEF) greatly enhanced the potential value of most LDEF materials, compared to the original 1-year flight plan. NASA recognized this potential by forming the LDEF Space Environmental Effects on Materials Special Investigation Group in early 1989 to address the expanded opportunities available in the LDEF structure and on experimental trays, so that the value of all LDEF materials to current and future space missions would be assessed and documented. The LDEF Materials Data Analysis Workshop served as one step toward the realization of that responsibility and ran concurrently with activities surrounding the successful return of the spacecraft to the NASA Kennedy Space Center. A compilation of visual aids utilized by speakers at the workshop is presented. Session 1 summarized current information on analysis responsibilities and plans and was aimed at updating the workshop attendees: the LDEF Advisory Committee, Principle Investigators, Special Investigation Group Members, and others involved in LDEF analyses or management. Sessions 2 and 3 addressed materials data analysis methodology, specimen preparation, shipment and archival, and initial plans for the LDEF Materials Data Base. A complementary objective of the workshop was to stimulate interest and awareness of opportunities to vastly expand the overall data base by considering the entire spacecraft as a materials experiment.

Stein, Bland A.↗
NASA NTRS1992

Nuclear electric propulsion: An integral part of NASA's nuclear propulsion project

NASA has initiated a technology program to establish the readiness of nuclear propulsion technology for the Space Exploration Initiative (SEI). This program was initiated with a very modest effort identified with nuclear thermal propulsion (NTP); however, nuclear electric propulsion (NEP) is also an integral part of this program and builds upon NASA's Base Research and Technology Program in power and electric propulsion as well as the SP-100 space nuclear power program. Although the Synthesis Group On America's SEI has identified NEP only as an option for cargo missions, recent studies conducted by NASA-Lewis show that NEP offers the potential for early manned Mars missions as well. Lower power NEP is also of current interest for outer planetary robotic missions. Current plans are reviewed for the overall nuclear propulsion project, with emphasis on NEP and those elements of NTP program which have synergism with NEP.

Stone, James R.↗
NASA NTRS2000

Constitutive and Stability Behavior of Soils in Microgravity Environment

All aspects of soil stability, bearing capacity, slope stability, the supporting capacity of deep foundations, and penetration resistance depend on soil strength. The stress-deformation and stress-deformation-time behavior of soils are of importance in any problem where ground movements are of interest. In most engineering materials, the strength is derived from internal chemical and physico-chemical forces of interaction, which bond the atoms, molecules, and particles together. In soils, the constitutive relations are mainly derived from interparticle friction between particles and particle groups and dilatancy, and to a lesser extent from particle bonding by weak electrostatic, physico-chemical, and coulomb forces. For engineering purposes, soils are classified as cohesive (clays and silts; typical particle sizes range from 10 nm to 10 micrometers) and cohesionless (sand and gravel; typical particle sizes range from 10 micrometers to 75 mm). The mechanical or constitutive properties of cohesionless soils or granular materials are highly fabric-dependent, highly non-linear, and non-conservative with engineering properties primarily depending on the effects of gravity through self-weight and on the tractions or forces applied to the soil mass. Under moderate-to-high stress levels, the influence of gravity on the behavior of laboratory test specimens may not be pronounced and, therefore, the test results in terrestrial (1-g) environment may be sufficiently conclusive. However at low interparticle stresses, which can result either from low applied (confining) stresses or from excess pore fluid pressures developed within the soil mass without corresponding changes in the applied stresses, the presence of gravitational body forces acting on solid particles and interstitial fluids exerts a pronounced influence on movement of individual particles or particle groups. Such motions, in turn, cause changes in soil fabric which results in significant changes in the interparticle friction forces contributing to the soil's strength and deformation characteristics.

Alshibli, Khalid A.↗
NASA NTRS2010

A New Representative for Small-Body Gravity Estimation

One of the options proposed in the 2009 Review of the U. S. Human Spaceflight Plans Committee calls for the consideration of robotic and human missions to asteroids. Beginning in 2000, the NEAR Shoemaker spacecraft inserted into orbit about the asteroid 433 Eros, and studied it for a year before landing. The Hayabusa satellite journeyed to 25143 Itokawa, and operated in a proximity of the asteroid for several months before landing to collect a return sample. Additionally, the DAWN satellite, which was launched in 2007, will explore the dwarf-planet Ceres and the asteroid 4 Vesta in the next three years. These are just several examples of current interests in exploring asteroids. In this paper, we explore an alternative for estimating the gravity field of a small body using observations of an orbiting satellite. Our approach uses two new mathematical tools, the quadratures (on a sphere) invariant under the icosahedral group, and a multiresolution representation of the gravity potential. With the near optimal quadratures on the sphere, we minimize the number of parameters needed to recover a function. Also, instead of estimating the coefficients of the spherical harmonics, the new quadratures allow us to estimate directly the values of the gravity field since they offer an analogue of the Lagrange-type interpolation.

Jones, Brandon A.↗
DOE OSTI2014

Strengthening Retrofit Markets for Comprehensive Savings in Multifamily Buildings (Interim Final Report)

Energy efficiency is vitally important in Maine. Nearly 70% of Maine households rely on fuel oil as their primary energy source for home heating, a higher share than in any other state. Coupled with the state's long, cold winters, Maine's dependence on oil renders homeowners particularly vulnerable to fluctuating fuel costs. With $\$$4.5 million in seed funding from the Energy Department's Better Buildings Neighborhood Program, the Governor's Energy Office (GEO), through Efficiency Maine Trust (the Trust), is spurring Maine landlords to lower their monthly energy bills and improve comfort for their tenants during the state's cold winter months and increasingly warmer summers. Maine's aging multifamily housing stock can be expensive to heat and costly to maintain. It is not unusual to find buildings with little or no insulation, drafty windows, and significant air leaks, making them ideal candidates for energy efficiency upgrades. Maine modeled its Multifamily Efficiency Program (MEP) after the state's highly successful Home Energy Savings Program (HESP) for single-family homes. HESP provided cash incentives and financing opportunities to owners of one-to four-unit structures, which resulted in thousands of energy assessments and whole-house energy upgrades in 225 communities. Maine's new MEP multifamily energy efficiency upgrade and weatherization initiative focuses on small to medium-sized (i.e., five to 20 units) apartment buildings. The program's energy efficiency upgrades will provide at least 20% energy savings for each upgraded multifamily unit. The Trust’s MEP relies on a network of approved program partners who help move projects through the pipeline from assessment to upgrade. MEP has two components: benchmarking and development of an Energy Reduction Plan (ERP). Using the ENERGY STAR® Portfolio Manager benchmarking tool, MEP provides an assessment of current energy usage in the building, establishes a baseline for future energy efficiency improvements, and enables tracking and monitoring of future energy usage at the building— all at no cost to the building owner. The ERP is developed by a program partner using either the Trust’s approved modeling or prescriptive tools; it provides detailed information about the current energy related conditions in the building and recommends energy efficiency, health, and safety improvements. The Trust's delivery contractor provides quality assurance and controls throughout the process. Through this effort, MEP's goal is to establish a self-sustaining, market-driven program, demonstrating the value of energy efficiency to other building owners. The increasing value of properties across the state will help incentivize these owners to continue upgrades after the grant period has ended. Targeting urban areas in Maine with dense clusters of multifamily units—such as Portland, Lewiston- Auburn, Bangor, and Augusta—MEP engaged a variety of stakeholder groups early on to design its multifamily program. Through direct emails and its website, program officials invited lending institutions, building professionals, engineering firms, equipment distributors, and local property owners associations to attend open meetings around the state to learn about the goals of the multifamily program and to help define its parameters. These meetings helped program administrators understand the diversity of the customer base: some owners are individuals with a single building, while other owners are groups of people or management companies with an entire portfolio of multifamily buildings. The diversity of the customer base notwithstanding, owners see MEP as an opportunity to make gains in their respective properties. Consistently high turnouts at stakeholder meetings fueled greater customer interest as awareness of the program spread through word of mouth. The program also gained traction by utilizing the program partner networks and building on the legacy of the Trust’s successful HESP for single-family residences. MEP offers significant incentives for building owners to participate in the upgrade program. Wholebuilding benchmarking services are available to most multifamily housing buildings free of charge. The service provides the building owner with an assessment of the building's current energy efficiency as compared to other multifamily buildings on a national scale, establishes a baseline to measure future improvements, and enables owners to track monthly energy consumption using the ENERGY STAR Portfolio Manager. Once the benchmarking process is complete, the program links building owners with approved program partners (e.g., energy professionals, home performance contractors) to identify and implement specific energy-saving opportunities in the building. Program partners can also provide project quotes with estimated financing incentives and payback period calculations that enable building owners to make informed decisions. What's more, the Trust provides two financial incentives for successful completion of program milestones. The first is a per-unit incentive for completion of an approved ERP (i.e., $\$$100 per unit if a prescriptive path is followed, and $\$$200 per unit for a modeled ERP). Upon final inspection of the installed project scope of work, an incentive of $\$$1,400 per unit or 50% of installed cost—whichever is less—is paid. The Trust originally established a $\$$1 million loan-loss reserve fund (LLRF) to further enhance financing opportunities for qualified multifamily building owners. This funding mechanism was designed to connect building owners with lenders that retain the mortgages for their properties and encourages the lenders to offer financing for energy efficiency improvements. However, there has been no interest in the LLRF and therefore the LLRF has been reduced. Ultimately, MEP plans to build an online tool for building owners to assess opportunities to make upgrades in their multifamily units. The tool will include a performance rating system to provide a way for building owners to more easily understand energy use in their building, and how it could be improved with energy efficiency upgrades. Prospective tenants will also be able to use the rating system to make informed decisions about where to rent. Furthermore, the rating can be incorporated into real estate listings as a way for prospective home buyers and the real estate financial community to evaluate a home's operating costs. The Trust’s MEP has identified the state's most experienced energy professionals, vendors, suppliers, and contractors that install energy efficiency equipment in the multifamily sector to be qualified program partners. To be eligible for partnership, energy assessment professionals and contractors are required to have demonstrated experience in the multifamily sector and hold associated professional certifications, such as Building Operator Certification (BOC), Certified Energy Manager (CEM), Professional Engineer (PE), or Building Performance Institute (BPI) Multifamily Building Analyst. Widespread program interest has enabled the Trust to redirect funds that might otherwise be needed for program promotion to building capacity through contractor training. In addition to boosting professional training and certification opportunities, MEP teaches its partners how to market the multifamily program to prospective multifamily homeowners.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗
DOE OSTI2020

SolSmart Webinar - Community Choice Aggregation & Solar Development

This webinar focuses on community choice aggregation (CCA) as a potential strategy for local governments to achieve their clean energy goals. The webinar provides an overview of what CCA is, how it works, and considerations for local governments interested in establishing or participating in a CCA program. The webinar will highlight case studies from CCAs across the U.S. that support local renewable energy development. This webinar provides one AICP CM continuing education credit. Who: Ben Butterwoth, Senior Associate, The Cadmus Group; Megan Lynch, Analyst, The Cadmus Group; Jenna Famular, Communications Manager, MCE Clean Energy; Meghan Shaw, Outreach Director for Cambridge Energy Alliance, City of Cambridge; Daniel Falk, Project Manager, The Solar Foundation

14 SOLAR ENERGY↗
DOE OSTI2022

Domestic and International Standards for Nuclear Criticality Safety – Overview and Status

The domestic and international consensus standards for nuclear criticality safety (NCS) have provided guidance for staff performing hands-on work in operations with fissionable materials. These consensus standards have contributed directly to the significant reduction in the rate of criticality accidents in process facilities since the 1940s. The last known criticality accident inside the United States was in 1978 (nearly 43 years ago) at the Idaho Chemical Processing Plant, and outside the United States, an accident occurred at Tokai-mura, Japan, in 1999 (23 years ago). The domestic consensus standards for NCS include the American Nuclear Society (ANS) standards. The ANS Standards Board, the NCS Consensus Committee, and the ANS-8 Subcommittee oversee the development and maintenance of these standards. There are currently eighteen standards in the ANS-8 series. Currently, there are six ANS-8 standards in revision mode and eleven in a maintenance mode with one new standard under development. The international consensus standards for NCS calculations, procedures, and practices are maintained and developed within the International Organization for Standardization (ISO), Technical Committee 85 on Nuclear Energy, Subcommittee 5 on Nuclear Fuel Technology, and Working Group 8, “Nuclear Criticality Safety.” Eleven standards are currently available, three standards are in revision mode, and two standards are development. This paper provides the NCS community with an overview and status report of domestic and international NCS consensus standards to stimulate interest and to support their continued development.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2022

Domestic and International Standards for Nuclear Criticality Safety - Overview & Status [Abstract]

The domestic and international consensus standards for nuclear criticality safety (NCS) have provided guidance for staff performing hands-on work in operations with fissionable materials. These consensus standards have contributed directly to the significant reduction in the rate of criticality accidents in process facilities since the 1940s. The last known criticality accident inside the United States was in 1978 (nearly 43 years ago) at the Idaho Chemical Processing Plant, and outside the United States, an accident occurred at Tokai-mura, Japan, in 1999 (22 years ago). The domestic consensus standards for NCS include the American Nuclear Society (ANS) standards. The ANS Standards Board, the NCS Consensus Committee, and the ANS-8 Subcommittee oversee the development and maintenance of these standards. There are currently eighteen standards in the ANS-8 series. Currently, there are six ANS-8 standards in re- vision mode and eleven in a maintenance mode with one new standard under development. The international consensus standards for NCS calculations, procedures, and practices are maintained and developed within the International Organization for Standardization, Technical Committee 85 on Nuclear Energy, Subcommittee 5 on Nuclear Fuel Technology, and Working Group 8, “Nuclear Criticality Safety.” Eleven standards are currently available, three standards are in revision mode, and two standards are development. This paper provides the NCS community with an overview and status report of domestic and international NCS consensus standards to stimulate interest and to support their continued development.

96 KNOWLEDGE MANAGEMENT AND PRESERVATION↗
DOE OSTI2014

Adapting SAFT-γ perturbation theory to site-based molecular dynamics simulation. II. Confined fluids and vapor-liquid interfaces

In this work, a new classical density functional theory is developed for group-contribution equations of state (EOS). Details of implementation are demonstrated for the recently-developed SAFT-γ WCA EOS and selective applications are studied for confined fluids and vapor-liquid interfaces. The acronym WCA (Weeks-Chandler-Andersen) refers to the characterization of the reference part of the third-order thermodynamic perturbation theory applied in formulating the EOS. SAFT-γ refers to the particular form of “statistical associating fluid theory” that is applied to the fused-sphere, heteronuclear, united-atom molecular models of interest. For the monomer term, the modified fundamental measure theory is extended to WCA-spheres. A new chain functional is also introduced for fused and soft heteronuclear chains. The attractive interactions are taken into account by considering the structure of the fluid, thus elevating the theory beyond the mean field approximation. The fluctuations of energy are also included via a non-local third-order perturbation theory. The theory includes resolution of the density profiles of individual groups such as CH{sub 2} and CH{sub 3} and satisfies stoichiometric constraints for the density profiles. New molecular simulations are conducted to demonstrate the accuracy of each Helmholtz free energy contribution in reproducing the microstructure of inhomogeneous systems at the united-atom level of coarse graining. At each stage, comparisons are made to assess where the present theory stands relative to the current state of the art for studying inhomogeneous fluids. Overall, it is shown that the characteristic features of real molecular fluids are captured both qualitatively and quantitatively. For example, the average pore density deviates ∼2% from simulation data for attractive pentadecane in a 2-nm slit pore. Another example is the surface tension of ethane/heptane mixture, which deviates ∼1% from simulation data while the theory reproduces the excess accumulation of ethane at the interface.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗