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Assessing Uncertainty in Modeling Stress Corrosion Cracking

Mendoza, Hector; Gilkey, Lindsay N.; Brooks, Dusty M.

This report summarizes the collaboration between Sandia National Laboratories (SNL) and the Nuclear Regulatory Commission (NRC) to improve the state of knowledge on chloride induced stress corrosion cracking (CISCC). The foundation of this work relied on using SNL’s CISCC computer code to assess the current state of knowledge for probabilistically modeling CISCC on stainless steel canisters. This work is presented as three tasks. The first task is exploring and independently comparing crack growth rate (CGR) models typically used in CISCC modeling by the research community. The second task is implementing two of the more conservative CGR models from the first task into SNL’s full CISCC code to understand the impact of the different CGR models on a full probabilistic analysis while studying uncertainty from three key input parameters. The combined work of the first two tasks showed that properly measuring salt deposition rates is impactful to reducing uncertainty when modeling CISCC. The work in Task 2 also showed how probabilistic CGR models can be more appropriate at capturing aleatory uncertainty when modeling SCC. Lastly, appropriate and realistic input parameters relevant for CISCC modeling were documented in the last task as a product of the simulations considered in the first two tasks.

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pvOps: a Python package for empirical analysis of photovoltaic field data

Journal of Open Source Software

Jackson, Nicole D.; Bonney, Kirk L.; Gunda, Thushara; Mendoza, Hector; Hopwood, Michael W.

The purpose of pvOps is to support empirical evaluations of data collected in the field related to the operations and maintenance (O&M) of photovoltaic (PV) power plants. pvOps presently contains modules that address the diversity of field data, including text-based maintenance logs, current-voltage (IV) curves, and timeseries of production information. The package functions leverage machine learning, visualization, and other techniques to enable cleaning, processing, and fusion of these datasets. These capabilities are intended to facilitate easier evaluation of field patterns and extraction of relevant insights to support reliability-related decision-making for PV sites. The open-source code, examples, and instructions for installing the package through PyPI can be accessed through the GitHub repository.

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Vapor transport analysis of a chloride molten salt flow control valve

AIP Conference Proceedings

Armijo, Kenneth M.; Mendoza, Hector; Parish, Jeffrey

This investigation explores thermal-fluid flow phenomena in a proportional flow control valve (FCV) within a 2 in. ID high-temperature piping transport system. The FCVs are critical components to ensure flexible nominal operation of a 2 MWth concentrating solar power (CSP) pilot-scale system in present development at Sandia National Laboratories (SNL). A computational fluid dynamics (CFD) / finite element analysis (FEA) model was developed in ANSYS that investigates multifluid phase-change transport within various sections of an FCV to explore plating and subsequent thermal-mechanical stress challenges that can exist with operations as high as 730°C. Results from the thermal-fluid model in development suggest salt vapor phase change in the N2 gas purge lines as low as approximately 476°C, which can have a negative impact on valve reliability.

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EMISSIONS ABATEMENT OF PEPPER ROASTING UTILIZING A CONCENTRATING SOLAR TOWER THERMAL HEAT SOURCE

Proceedings of ASME 2022 16th International Conference on Energy Sustainability, ES 2022

Armijo, Kenneth M.; Overacker, Aaron A.H.; Mendoza, Hector; Madden, Dimitri A.; Foulk, James W.; Armijo, Kenneth I.; Montoya, Randolph

Research is presented for carbon emissions abatement utilizing concentrating solar power (CSP) heating for culinary industrial process heat applications of roasting peppers. For this investigation the Sandia National Laboratories (SNL) performed high-intensity flux profile heating, as high as approximately 12.2 W/cm2 roasting peppers near 615oC. This work also explores the suitability of culinary roasting as applied to different forms of CSP heating as well as techno-economic costs. Traditionally, chile pepper roasting has used propane gas source heating to achieve similar temperatures and food roasting profiles in batch style processing. Here, the investigators roasted peppers on the top level of the National Solar Thermal Test Facility (NSTTF) solar tower for multiple roasting trials, with and without water. For comparison, the team also performed roasting from a traditional propane gas heating source, monitoring the volume of propane being consumed over time to assess carbon emissions that were abated using CSP. Results found that roasting peppers with CSP facilitated approximately 26 MJ of energy that abated approximately 0.122 kg CO2/kg chile for a 10 kg bag. The team also determined that pre-wetting the peppers before roasting both under propane and CSP heat sources increased the roast time by approximately 3 minutes to achieve the same qualitative optimal roast state compared to dry peppers.

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Fire-Induced Pressure Response and Failure Characterization of PCV/SCV/3013 Containers - Phase 3

Mendoza, Hector; Baird, Austin R.; Gill, Walter; Figueroa Faria, Victor G.; Mcclard, James; Sprankle, Ray; Hensel, Steve; Michel, Danielle; Adee, Shane M.

Several Department of Energy (DOE) facilities have materials stored in robust, welded, stainless - steel containers with presumed fire - induced pressure response behaviors. Lack of test data related to fire exposure requires conservative safety analysis assumptions for container response at these facilities. This conservatism can in turn result in the implementation of challenging operational restrictions with costly nuclear safety controls. To help address this issue for sites that store DOE 3013 stainless - steel containers, a series of ten tests were undertaken at Sandia National Laboratories. The goal of this test series was to obtain the response behavior for various configurations of DOE 3013 containers with various payload compositions when exposed to one of two ASTM fire conditions. Key parameters measured in the test series included identification of failure - specific characteristics such as pressure, temperature, and whether or not a vessel was breached during a test . Numerous failure - specific characteristics were identified from the ten tests. This report describes the implementation and execution of the test series performed to identify these failure - specific characteristics. Discussions on the test configurations, payload compositions, thermal insults, and experimental setups are presented. Test results in terms of pressurization and vessel breach (or no - breach) are presented along with corresponding discussions for each test.

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Continued Investigations of Respirable Release Fractions for Stress Corrosion Crack-Like Geometries

Durbin, S.; Pulido, Ramon J.; Perales, Adrian G.; Lindgren, Eric; Jones, Philip G.; Mendoza, Hector; Phillips, Jesse; Lanza, M.; Casella, A.

The formation of a stress corrosion crack (SCC) in the canister wall of a dry cask storage system (DCSS) has been identified as a potential issue for the long-term storage of spent nuclear fuel. The presence of an SCC in a storage system could represent a through-wall flow path from the canister interior to the environment. Modern, vertical DCSSs are of particular interest due to the commercial practice of using relatively high backfill pressures (up to approximately 800 kPa) in the canister to enhance internal natural convection. This pressure differential offers a comparatively high driving potential for blowdown of any particulates that might be present in the canister. In this study, the rates of gas flow and aerosol transmission of a spent fuel surrogate through an engineered microchannel with dimensions representative of an SCC were evaluated experimentally using coupled mass flow and aerosol analyzers. The microchannel was formed by mating two gage blocks with a linearly tapering slot orifice nominally 13 μm (0.005 in.) tall on the upstream side and 25 μm (0.0010 in.) tall on the downstream side. The orifice is 12.7 mm (0.500 in.) wide by 8.89 mm (0.350 in.) long (flow length). Surrogate aerosols of cerium oxide, CeO2, were seeded and mixed with either helium or air inside a pressurized tank. The aerosol characteristics were measured immediately upstream and downstream of the simulated SCC at elevated and ambient pressures, respectively. These data sets are intended to demonstrate a new capability to characterize SCCs under well-controlled boundary conditions. Modeling efforts were also initiated that evaluate the depletion of aerosols in a commercial dry storage canister. These preliminary modeling and ongoing testing efforts are focused on understanding the evolution in both size and quantity of a hypothetical release of aerosolized spent fuel particles from failed fuel to the canister interior and ultimately through an SCC.

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PvOps: Improving Operational Assessments through Data Fusion

Conference Record of the IEEE Photovoltaic Specialists Conference

Mendoza, Hector; Hopwood, Michael W.; Gunda, Thushara

PV system reliability analyses often depend on production data to evaluate the system state. However, using this information alone leads to incomplete assessments, since contextual information about potential sources of data quality issues is lacking (e.g., missing data from offline communications vs. offline production). This paper introduces a new Python-based software capability (called pvOps) for fusing production data with readily available text-based maintenance information to improve reliability assessments. In addition to details about the package development process, the general capabilities to gain actionable insights using field data are presented through a case study. These findings highlight the significant potential for continued advancements in operational assessments.

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PvOps: Improving Operational Assessments through Data Fusion

Conference Record of the IEEE Photovoltaic Specialists Conference

Mendoza, Hector; Hopwood, Michael W.; Gunda, Thushara

PV system reliability analyses often depend on production data to evaluate the system state. However, using this information alone leads to incomplete assessments, since contextual information about potential sources of data quality issues is lacking (e.g., missing data from offline communications vs. offline production). This paper introduces a new Python-based software capability (called pvOps) for fusing production data with readily available text-based maintenance information to improve reliability assessments. In addition to details about the package development process, the general capabilities to gain actionable insights using field data are presented through a case study. These findings highlight the significant potential for continued advancements in operational assessments.

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Correlating incident heat flux and source temperature to meet astm e1529 requirements for ram packaging components thermal testing

American Society of Mechanical Engineers, Pressure Vessels and Piping Division (Publication) PVP

Baird, Austin R.; Gill, Walter; Mendoza, Hector; Figueroa Faria, Victor G.

Often in fire resistance testing of packaging vessels and other components, both the heat source temperature and the incident heat flux on a test specimen need to be measured and correlated. Standards such as ASTM E1529 require a specified temperature range from the heat source and a specified heat flux on the surface of the test specimen. There are other standards that have similar requirements. The geometry of the test environment and specimen may make heat flux measurements using traditional instruments (directional flame thermometers (DFTs) and water-cooled radiometers) difficult to implement. Orientation of the test specimen with respect to the thermal environment is also important to ensure that the heat flux on the surface of the test specimen is properly measured. Other important factors in the flux measurement include the thermal mass and surface emissivity of the test specimen. This paper describes the development of a cylindrical calorimeter using water-cooled wide-angle Schmidt-Bolter gauges to measure the incident heat flux for a vessel exposed to a radiant heat source. The calorimeter is designed to be modular to be modular with multiple configurations while meeting emissivity and thermal mass requirements via a variable thermal mass. The results of the incident heat flux and source temperature along with effective/apparent emissivity calculations are discussed.

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Development and validation of radiant heat systems to test ram packages under non-uniform thermal environments

American Society of Mechanical Engineers, Pressure Vessels and Piping Division (Publication) PVP

Mendoza, Hector; Gill, Walter; Figueroa Faria, Victor G.; Sanborn, Scott E.

Certification of radioactive material (RAM) packages for storage and transportation requires multiple tiers of testing that simulate accident conditions in order to assure safety. One of these key testing aspects focuses on container response to thermal insults when a package includes materials that decompose, combust, or change phase between-40 °C and 800 °C. Thermal insult for RAM packages during testing can be imposed from a direct pool fire, but it can also be imposed using a furnace or a radiant heat system. Depending on variables such as scale, heating rates, desired environment, intended diagnostics, cost, etc., each of the different methods possess their advantages and disadvantages. While a direct fire can be the closest method to represent a plausible insult, incorporating comprehensive diagnostics in a controlled fire test can pose various challenges due to the nature of a fire. Radiant heat setups can instead be used to impose a comparable heat flux on a test specimen in a controlled manner that allows more comprehensive diagnostics. With radiant heat setups, however, challenges can arise when attempting to impose desired nonuniform heat fluxes that would account for specimen orientation and position in a simulated accident scenario. This work describes the development, implementation, and validation of a series of techniques used by Sandia National Laboratories to create prescribed non-uniform thermal environments using radiant heat sources for RAM packages as large as a 55-gallon drum.

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Fire-induced pressure response and failure of 3013 containers

American Society of Mechanical Engineers, Pressure Vessels and Piping Division (Publication) PVP

Mendoza, Hector; Gill, Walter; Baird, Austin R.; Figueroa Faria, Victor G.; Hensel, Steve; Sanborn, Scott E.

Several Department of Energy (DOE) facilities have nuclear or hazardous materials stored in robust, welded, stainless-steel containers with undetermined fire-induced pressure response behaviors. Lack of test data related to fire exposure requires conservative safety analysis assumptions for container response at these facilities. This conservatism can in turn result in the implementation of challenging operational restrictions with costly nuclear safety controls. To help address this issue for sites that store DOE 3013 stainless-steel containers, a series of five tests were undertaken at Sandia National Laboratories. The goal of this test series was to obtain the response behavior for various configurations of the DOE 3013 containers when exposed to various fire conditions. Key parameters measured in the test series included identification of failure-specific characteristics such as pressure, temperature, and leak/burst failure type. This paper describes the development and execution of the test series performed to identify these failure-specific characteristics. Work completed to define the test configurations, payload compositions, thermal insults, and experimental setups are discussed. Test results are presented along with corresponding discussions for each test.

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Development and validation of radiant heat systems to test ram packages under non-uniform thermal environments

American Society of Mechanical Engineers Pressure Vessels and Piping Division Publication PVP

Mendoza, Hector; Gill, Walter; Figueroa Faria, Victor G.; Sanborn, Scott E.

Certification of radioactive material (RAM) packages for storage and transportation requires multiple tiers of testing that simulate accident conditions in order to assure safety. One of these key testing aspects focuses on container response to thermal insults when a package includes materials that decompose, combust, or change phase between-40 °C and 800 °C. Thermal insult for RAM packages during testing can be imposed from a direct pool fire, but it can also be imposed using a furnace or a radiant heat system. Depending on variables such as scale, heating rates, desired environment, intended diagnostics, cost, etc., each of the different methods possess their advantages and disadvantages. While a direct fire can be the closest method to represent a plausible insult, incorporating comprehensive diagnostics in a controlled fire test can pose various challenges due to the nature of a fire. Radiant heat setups can instead be used to impose a comparable heat flux on a test specimen in a controlled manner that allows more comprehensive diagnostics. With radiant heat setups, however, challenges can arise when attempting to impose desired nonuniform heat fluxes that would account for specimen orientation and position in a simulated accident scenario. This work describes the development, implementation, and validation of a series of techniques used by Sandia National Laboratories to create prescribed non-uniform thermal environments using radiant heat sources for RAM packages as large as a 55-gallon drum.

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Determining airborne release fraction from dot 7A drums exposed to a thermal insult

International Conference on Nuclear Engineering, Proceedings, ICONE

Mendoza, Hector; Figueroa Faria, Victor G.; Gill, Walter; Sanborn, Scott E.

Fire suppression systems for transuranic (TRU) waste facilities are designed to minimize radioactive material release to the public and to facility employees in the event of a fire. Currently, facilities with Department of Transportation (DOT) 7A drums filled with TRU waste follow guidelines that assume a fraction of the drums experience lid ejection in case of a fire. This lid loss is assumed to result in significant TRU waste material from the drum experiencing an unconfined burn during the fire, and fire suppression systems are thus designed to respond and mitigate potential radioactive material release. However, recent preliminary tests where the standard lid filters of 7A drums were replaced with a UT-9424S filter suggest that the drums could retain their lid if equipped with this filter. The retention of the drum lid could thus result in a very different airborne release fraction (ARF) of a 7A drum's contents when exposed to a pool fire than what is assumed in current safety basis documents. This potentially different ARF is currently unknown because, while studies have been performed in the past to quantify ARF for 7A drums in a fire, no comprehensive measurements have been performed for drums equipped with a UT-9424S filter. If the ARF is lower than what is currently assumed, it could change the way TRU waste facilities operate. Sandia National Laboratories has thus developed a set of tests and techniques to help determine an ARF value for 7A drums filled with TRU waste and equipped with a UT-9424S filter when exposed to the hypothetical accident conditions (HAC) of a 30-minute hydrocarbon pool fire. In this multi-phase test series, SNL has accomplished the following: (1) performed a thermogravimetric analysis (TGA) on various combustible materials typically found in 7A drums in order to identify a conservative load for 7A drums in a pool fire; (2) performed a 30-minute pool fire test to (a) determine if lid ejection is possible under extreme conditions despite the UT-9424S filter, and (b) to measure key parameters in order to replicate the fire environment using a radiant heat setup; and (3) designed a radiant heat setup to demonstrate capability of reproducing the fire environment with a system that would facilitate measurements of ARF. This manuscript thus discusses the techniques, approach, and unique capabilities SNL has developed to help determine an ARF value for DOT 7A drums exposed to a 30-minute fully engulfing pool fire while equipped with a UT-9424S filter on the drum lid.

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Nuclear Risk Assessment 2019 Update for the Mars 2020 Mission Environmental Impact Statement

Clayton, Daniel J.; Wilkes, John R.; Starr, Michael; Ehrhart, Brian D.; Mendoza, Hector; Ricks, Allen J.; Villa, Daniel L.; Potter, Donald L.; Dinzl, Derek J.; Fulton, John; Foulk, James W.; Cochran, Lainy D.; Brooks, Dusty M.

In the summer of 2020, the National Aeronautics and Space Administration (NASA) plans to launch a spacecraft as part of the Mars 2020 mission. The rover on the proposed spacecraft will use a Multi-Mission Radioisotope Thermoelectric Generator (MMRTG) to provide continuous electrical and thermal power for the mission. The MMRTG uses radioactive plutonium dioxide. NASA is preparing a Supplemental Environmental Impact Statement (SEIS) for the mission in accordance with the National Environmental Policy Act. This Nuclear Risk Assessment addresses the responses of the MMRTG option to potential accident and abort conditions during the launch opportunity for the Mars 2020 mission and the associated consequences. This information provides the technical basis for the radiological risks discussed in the SEIS.

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Pipe Overpack Container Fire Testing: Phase II-B

Mendoza, Hector; Figueroa Faria, Victor G.; Gill, Walter; Ammerman, Douglas; Sanborn, Scott E.

The Pipe Overpack Container (POC) was developed at Rocky Flats to transport plutonium residues with higher levels of plutonium than standard transuranic (TRU) waste to the Waste Isolation Pilot Plant (WIPP) for disposal. In 1996 Sandia National Laboratories (SNL) conducted a series of tests to determine the degree of protection POCs provided during storage accident events. One of these tests exposed four of the POCs to a 30-minute engulfing pool fire. This test resulted in one of the POCs generating sufficient internal pressure to pop off its drum lid and expose the top of the pipe container (PC) to the fire environment. The initial contents of the POCs were inert materials that would not generate large internal pressure within the PC if heated. However, POCs are now being used to store combustible Transuranic (TRU) waste at Department of Energy (DOE) sites. At the request of DOE's Office of Environmental Management (EM) and National Nuclear Security Administration (NNSA), SNL started conducting a new series of fire tests in 2015 to examine whether PCs with combustibles would reach a temperature that could result in: (1) decomposition of inner contents and (2) subsequent generation of sufficient gas to cause the PC to over-pressurize and release its inner contents. In 2016, Phase II of the tests showed that POCs tested in a pool fire failed within 3 minutes of ignition with the POC lid ejecting. These POC lids were fitted with a NUCFIL-019DS filter and revealed that this specific filter did not relieve sufficient pressure to prevent lid ejection. In the Fall of 2017, Phase II-A was conducted to expose POCs to a 30-minute pool fire with similar configurations to those tested in Phase II, except that the POC lids were fitted with an UltraTech (UT) 9424S filter instead. That specific filter was chosen because of its design to help relieve internal pressure during the fire and thus prevent lid ejection. In Phase II-A, however, setups of two POCs stacked upon one another were never tested, which led to this phase of tests, Phase II-B. This report will describe the various tests conducted in Phase II-B, present results from these tests, and implications for the POCs based on the test results will be discussed.

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Fire-Induced Pressure Response and Failure Characterization of PCV/SCV/3013 Containers - Phase 1

Mendoza, Hector; Gill, Walter; Sprankle, Ray; Shefferman, Alex; Figueroa Faria, Victor G.; Sanborn, Scott E.

This report discusses the test series performed at Sandia National Laboratories (SNL) to test the response of Primary Containment Vessels (PCVs) under a hypothetical fire scenario. The PCV is the innermost container in a 9975 shipping package (NRC, 2014). This test series was the first of three phases aiming to characterize the PCV/SCV/3013 system, and it will be referred to as Phase 1. The purpose of these tests was to characterize the response of the PCV wall when filled with a bounding payload and exposed to an ASTM-E1529 (ASTM, 2014) standard fire environment. In particular, the goal was to test a working hypothesis for these PCVs: that, during a scenario where the PCV is exposed to an ASTM-E1529 standard fire environment, the accumulated internal pressure (resulting from the expansion of gases and vaporization of moisture/plastics during heat exposure) relieves through the O-ring segment of the PCV before PCV wall failure (rupture). Bounding internal and external conditions were purposefully established for this Phase 1 testing in order to maximize pressurization in the container. Specifically, this Phase 1 test series is designed to determine the worst case thermal stress conditions by exposing five SRNS PCVs with identical payloads to the severe ASTM-E1529 fire conditions in five different configurations with increasing potential to result in a release of the internal contents (i.e. failure). All five tests were successfully executed, and the failure modes were characterized for each test. This report discusses the details of the five tests performed in this phase, their outcomes, and their implications.

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A verified conformal decomposition finite element method for implicit, many-material geometries

Journal of Computational Physics

Roberts, Scott A.; Mendoza, Hector; Brunini, Victor; Noble, David R.

As computing power rapidly increases, quickly creating a representative and accurate discretization of complex geometries arises as a major hurdle towards achieving a next generation simulation capability. Component definitions may be in the form of solid (CAD) models or derived from 3D computed tomography (CT) data, and creating a surface-conformal discretization may be required to resolve complex interfacial physics. The Conformal Decomposition Finite Element Methods (CDFEM) has been shown to be an efficient algorithm for creating conformal tetrahedral discretizations of these implicit geometries without manual mesh generation. In this work we describe an extension to CDFEM to accurately resolve the intersections of many materials within a simulation domain. This capability is demonstrated on both an analytical geometry and an image-based CT mesostructure representation consisting of hundreds of individual particles. Effective geometric and transport properties are the calculated quantities of interest. Solution verification is performed, showing CDFEM to be optimally convergent in nearly all cases. Representative volume element (RVE) size is also explored and per-sample variability quantified. Relatively large domains and small elements are required to reduce uncertainty, with recommended meshes of nearly 10 million elements still containing upwards of 30% uncertainty in certain effective properties. This work instills confidence in the applicability of CDFEM to provide insight into the behaviors of complex composite materials and provides recommendations on domain and mesh requirements.

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Pipe Overpack Container Fire Testing: Phase II-A

Mendoza, Hector; Figueroa Faria, Victor G.; Gill, Walter; Ammerman, Douglas; Sanborn, Scott E.

The Pipe Overpack Container (POC) was developed at Rocky Flats to transport plutonium residues with higher levels of plutonium than standard transuranic (TRU) waste to the Waste Isolation Pilot Plant (WIPP) for disposal. In 1996 Sandia National Laboratories (SNL) conducted a series of tests to determine the degree of protection POCs provided during storage accident events. One of these tests exposed four of the POCs to a 30-minute engulfing pool fire, resulting in one of the 7A drum overpacks generating sufficient internal pressure to pop off its lid and expose the top of the pipe container (PC) to the fire environment. The initial contents of the POCs were inert materials, which would not generate large internal pressure within the PC if heated. However, POCs are now being used to store combustible Transuranic (TRU) waste at Department of Energy (DOE) sites. At the request of DOE's Office of Environmental Management (EM) and National Nuclear Security Administration (NNSA), SNL started conducting a new series of fire tests in 2015 to examine whether PCs with combustibles would reach a temperature that would result in (1) decomposition of inner contents and (2) subsequent generation of sufficient gas to cause the PC to overpressurize and release its inner content. In 2016, Phase II tests showed that POCs tested in a pool fire failed within 3 minutes of ignition with the POC lid ejecting. These POC lids were fitted with an all-metal (NUCFIL019DS) filter and revealed that this specific filter did not relieve sufficient pressure to prevent lid ejection. For the test phase discussed in this report, Phase II-A, the POCs are exposed to a 30-minute pool fire, with similar configurations to those tested in Phase II, except that the POC lids are fitted with a hybrid metal-polyethylene (UT9424S) filter instead. This report will: describe the various tests conducted in Phase II-A, present results from these tests, and discuss implications for the POCs based on the test results.

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Digital Rock Physics and 3D Printing for Fractured Porous Media

Martinez, Mario J.; Yoon, Hongkyu; Kucala, Alec; Dewers, Thomas; Mendoza, Hector

Imaging techniques for the analysis of porous structures have revolutionized our ability to quantitatively characterize geomaterials. Digital representations of rock from CT images and physics modeling based on these pore structures provide the opportunity to further advance our quantitative understanding of fluid flow, geomechanics, and geochemistry, and the emergence of coupled behaviors. Additive manufacturing, commonly known as 3D printing, has revolutionized production of custom parts with complex internal geometries. For the geosciences, recent advances in 3D printing technology may be co-opted to print reproducible porous structures derived from CT-imaging of actual rocks for experimental testing. The use of 3D printed microstructure allows us to surmount typical problems associated with sample-to-sample heterogeneity that plague rock physics testing and to test material response independent from pore-structure variability. Together, imaging, digital rocks and 3D printing potentially enables a new workflow for understanding coupled geophysical processes in a real, but well-defined setting circumventing typical issues associated with reproducibility, enabling full characterization and thus connection of physical phenomena to structure. Here we report on our research exploring the possibilities that these technologies can bring to geosciences for coupled multiscale experimental and numerical analysis using 3D printed fractured rock specimens.

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Insights into lithium-ion battery degradation and safety mechanisms from mesoscale simulations using experimentally reconstructed mesostructures

Journal of Electrochemical Energy Conversion and Storage

Roberts, Scott A.; Mendoza, Hector; Brunini, Victor; Trembacki, Bradley L.; Noble, David R.; Grillet, Anne M.

Battery performance, while observed at the macroscale, is primarily governed by the bicontinuous mesoscale network of the active particles and a polymeric conductive binder in its electrodes. Manufacturing processes affect this mesostructure, and therefore battery performance, in ways that are not always clear outside of empirical relationships. Directly studying the role of the mesostructure is difficult due to the small particle sizes (a few microns) and large mesoscale structures. Mesoscale simulation, however, is an emerging technique that allows the investigation into how particle-scale phenomena affect electrode behavior. In this manuscript, we discuss our computational approach for modeling electrochemical, mechanical, and thermal phenomena of lithium-ion batteries at the mesoscale. We review our recent and ongoing simulation investigations and discuss a path forward for additional simulation insights.

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Results 1–50 of 56
Results 1–50 of 56