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DOE OSTI2019

Spatially resolved degradation during startup and shutdown in polymer electrolyte membrane fuel cell operation

Polymer electrolyte membrane fuel cells have durability limitations associated with the startup and shutdown of the fuel cell, which is critical for real-world vehicle commercialization. During startup or shutdown, there exists an active region (hydrogen/air) and a passive region (air/air) between the cell inlet and outlet. Internal currents are generated in the passive region causing high-potential excursion in the cathode leading to accelerated carbon corrosion. In this study, a segmented cathode hardware is used to evaluate the effect of platinum loading on both cathode and anode, and carbon support material on degradation due to repeated series of startups or shutdowns. Here, in situ losses in the performance and electrochemical surface area were measured spatially, and ex situ analysis of the catalyst layer thickness and platinum particle size was performed to understand the effect of startup or shutdown on different membrane electrode assembly materials. Startup degrades the region near anode outlet more, while shutdown degrades the region near anode inlet more compared to the rest of the electrode. While various system mitigation strategies have been reported in the literature to limit this degradation, one materials mitigation strategy is to limit the anode's ability to reduce oxygen to water through increasing the ratio of platinum loading in the cathode to the anode, or by using a bi-functional catalyst.

25 ENERGY STORAGE↗

DOE OSTI2017

Improved Safety Injection Flow Map Associated with Target RCS Depressurization to Maintain Core Coolability of OPR1000

In Korea, Severe Accident Management Guidance (SAMG) for Optimized Power Reactor (OPR1000) has been developed through the research results related to the WOG SAMG, in which the operation phase shifts from the Emergency Operation Procedure (EOP) to the SAMG when the Core Exit Temperature (CET) reaches 923 K. Among 7 mitigation strategies envisioned, the third management strategy, injecting coolant into Reactor Coolant System (RCS) by depressurizing the RCS is one of the key strategies to fortify the in-vessel retention capability. As an aid to such mitigation strategy, a safety injection (SI) flow map has been developed by Lee et al. for predicting required flow rate associated with target RCS depressurization to recover in-vessel coolability. The mechanistic SI flow map used the CET increase rate and core water level decrease rate obtained from MELCOR code simulation. It should be noted that during the severe accident, the total heat generated is sum of the decay heat and the oxidation heat. Thus, it is necessary to consider additional heat sources by oxidation reaction between cladding, structure, control rod, and hot steam prior to the injection of coolant. It was believed that the SI model estimated required flow rate rather conservatively by considering the expected amount decay heat and the accumulated heat in the core based on the RCS pressure. However, it was confirmed that the SI model developed by Lee et al. could not represent the total heat removal especially since start of oxidation. Under transient conditions, the heat sources accumulated in the heat structures (fuel, cladding, supporting structures) should be embarked in the model for accurate contribution of the total heat source to the required flow rate. Therefore, the objective of this study is to improve the previous SI flow map predicting the injection flow rate associated with target RCS depressurization to satisfy the in-vessel coolability during severe accidents. Additional terms were developed to reflect accurate heat accumulating and included in the existing model. Resulting SI flow map includes the target RCS depressurization, which enables discharge of the required flow rate by utilizing the flow rate-pressure curve with operation of two high pressure safety injections (HPSIs). Also recent MELCOR simulation result of a postulated steam generator tube rupture (SGTR) accident verified the accuracy of the improved map.

11 NUCLEAR FUEL CYCLE AND FUEL MATERIALS↗

DOE OSTI2021

Multizonal modeling of SARS-CoV-2 aerosol dispersion in a virtual office building

The dispersion of indoor airborne contaminants across different zones within a mechanically ventilated building is a complex phenomenon driven by multiple factors. In this study, we modeled the indoor dispersion of airborne SARS-CoV-2 aerosols within a US Department of Energy detailed medium office prototype building using CONTAM software. The aim of this study is to improve our understanding about how different parts of a building can experience varying concentrations of the airborne viruses under different circumstances of release and mitigation strategies. Results indicate that unventilated stairwells can have significantly higher concentrations of airborne viruses. The mitigation strategies of morning and evening flushing of conditioned zones were not found to be very effective. Instead, a constant high percentage of outdoor air in the supply mix, and the use of masks, portable HEPA air cleaners, MERV 13 or higher HVAC air filters, and ultraviolet germicidal irradiation disinfection were effective strategies to prevent airborne viral contamination in the majority of the simulated office building.

60 APPLIED LIFE SCIENCES↗

DOE OSTI2020

After the hurricane: Validating a resilience assessment methodology

With increasing utility grid outages in the United States, there is growing interest in assessing risk and developing mitigation strategies to reduce the impact of grid outages. Working with the U.S. Air Force, the U.S. Department of Energy's National Renewable Energy Laboratory (NREL) developed a replicable energy resilience assessment methodology and investment decision tool to: (1) identify and score hazards and vulnerabilities at the site level; (2) analyze risks to energy infrastructure; and (3) identify and prioritize energy resilience investments. This work improves on existing resilience assessment methodologies and tools by combining a bottom-up, all-hazards assessment methodology with top-down geographic information system mapping capabilities to provide an innovative, dynamic tool for identifying and prioritizing actionable solutions. This process combines probabilistic forecasting with an iterative approach for continuously updating and reassessing risks to address temporal dynamism. Relationships among systems are modeled and visualized to estimate the effectiveness of resilience actions across multiple interdependent systems and inform financial priorities through cost-difficulty-impact trade-offs. The approach is validated in a case study at Tyndall Air Force Base (AFB) in Florida, which experienced a Category 5 hurricane in 2018. The risks and mitigation strategies identified pre-hurricane are compared with post-hurricane, realized impacts. The assessment effectively identifies risks and actions to increase site energy resilience, but the methodology can be enhanced though greater consideration of the interdependencies between the energy system and related systems like transportation, communication, and food/water systems, which impact the recovery of the energy system and the base.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

DOE OSTI2021

CalWave Design for PacWave - Preliminary Design Phase - Risk Management Plan

The project objectives for CalWave's deployment at PacWave are distinguished by the Preliminary Design Phase and the Detailed Design Phase. During the Preliminary Design Phase, the Risk Register was established to identify risks and mitigation strategies. The Risk Management Plan assesses potential risks of CalWave's technology and accompanying processes and describes the risk mitigation strategies for the project.

16 TIDAL AND WAVE POWER↗

DOE OSTI2021

Self-Cleaning Cathodes for Endurance to Chromium Poisoning

Chromium (Cr) poisoning remains a significant issue in long-term solid oxide fuel cell (SOFC) operation. While the addition of Cr in the interconnect and balance-of-plant (BOP) materials is effective in improving their resistance to oxidation, it also causes the deposition of resistive phases in the air electrode and thus cell performance loss. Previous work has investigated the mitigation of chromium deposition using getters, Cr diffusion resistant coatings, and more chromium-tolerant air electrode materials. However, these mitigation strategies merely postpone the degradation of performance due to Cr poisoning. Additionally, some strategies require the replacement of components, e.g., use of getters. Here we investigated a new, in-situ Cr poisoning mitigation strategy.

30 DIRECT ENERGY CONVERSION↗

DOE OSTI2017

Land quality, sustainable development and environmental degradation in agricultural districts: A computational approach based on entropy indexes

Land Degradation (LD) in socio-environmental systems negatively impacts sustainable development paths. This study proposes a framework to LD evaluation based on indicators of diversification in the spatial distribution of sensitive land. We hypothesize that conditions for spatial heterogeneity in a composite index of land sensitivity are more frequently associated to areas prone to LD than spatial homogeneity. Spatial heterogeneity is supposed to be associated with degraded areas that act as hotspots for future degradation processes. A diachronic analysis (1960–2010) was performed at the Italian agricultural district scale to identify environmental factors associated with spatial heterogeneity in the degree of land sensitivity to degradation based on the Environmentally Sensitive Area Index (ESAI). In 1960, diversification in the level of land sensitivity measured using two common indexes of entropy (Shannon's diversity and Pielou's evenness) increased significantly with the ESAI, indicating a high level of land sensitivity to degradation. In 2010, surface area classified as “critical” to LD was the highest in districts with diversification in the spatial distribution of ESAI values, confirming the hypothesis formulated above. Entropy indexes, based on observed alignment with the concept of LD, constitute a valuable base to inform mitigation strategies against desertification. - Highlights: • Spatial heterogeneity is supposed to be associated with degraded areas. • Entropy indexes can inform mitigation strategies against desertification. • Assessing spatial diversification in the degree of land sensitivity to degradation. • Mediterranean rural areas have an evident diversity in agricultural systems. • A diachronic analysis carried out at the Italian agricultural district scale.

54 ENVIRONMENTAL SCIENCES↗

DOE OSTI2013

Impacts of Variability and Uncertainty in Solar Photovoltaic Generation at Multiple Timescales

The characteristics of variability and uncertainty of PV solar power have been studied extensively. These characteristics can create challenges for system operators who must ensure a balance between generation and demand while obeying power system constraints at the lowest possible cost. A number of studies have looked at the impact of wind power plants, and some recent studies have also included solar PV. The simulations that are used in these studies, however, are typically fixed to one time resolution. This makes it difficult to analyze the variability across several timescales. In this study, we use a simulation tool that has the ability to evaluate both the economic and reliability impacts of PV variability and uncertainty at multiple timescales. This information should help system operators better prepare for increases of PV on their systems and develop improved mitigation strategies to better integrate PV with enhanced reliability. Another goal of this study is to understand how different mitigation strategies and methods can improve the integration of solar power more reliably and efficiently.

14 SOLAR ENERGY↗

DOE OSTI2018

General Equilibrium Analysis of the Cobenefits and Trade-Offs of Carbon Mitigation on Local Industrial Water Use and Pollutants Discharge in China

Carbon mitigation strategies have been developed without sufficient consideration of their impacts on the water system. Here, our study evaluates whether carbon mitigation strategies would decrease or increase local industrial water use and water-related pollutants discharge by using a computable general equilibrium (CGE) model coupled with a water withdrawals and pollutants discharge module in Shenzhen, the fourth largest city in China. To fulfill China’s Nationally Determined Contributions (NDC) targets, Shenzhen’s GDP and welfare losses are projected to be 1.6% and 5.6% in 2030, respectively. The carbon abatement cost will increase from 56 USD/t CO2 in 2020 to 274 USD/t CO2 in 2030. The results reveal that carbon mitigation accelerates local industrial structure upgrading by restricting carbon-, energy-, and water-intensive industries, e.g., natural gas mining, nonmetal, agriculture, food production, and textile sectors. Accordingly, carbon mitigation improves energy use efficiency and decreases 55% of primary energy use in 2030. Meanwhile, it reduces 4% of total industrial water use and 2.2–2.4% of two major pollutants discharge, i.e., CODCr and NH3–N. Carbon mitigation can also decrease petroleum (2.2%) and V-ArOH (0.8%) discharge but has negative impacts on most heavy metal(loid)s pollutants discharge (increased by -0.01% to 4.6%). These negative impacts are evaluated to be negligible on the environment. This study highlights the importance of considering the energy–water nexus for better-coordinated energy and water resources management at local and national levels.

Su, Qiong↗

DOE OSTI2019

Piperazine aerosol mitigation for post-combustion carbon capture

Amine loss as aerosol is still a challenge for reliable long-term operations in amine scrubbing units. While attempts have been made to understand, predict, and mitigate amine aerosol growth in the absorber, demonstration of the mitigation of piperazine (PZ) aerosol has not been published. This paper presents results from a comprehensive emission study using 5 m PZ. The focus of this work is not to validate growth mechanisms, but to provide data from which existing hypotheses can be analyzed. PZ aerosol at the water wash outlet was characterized by Fourier Transform Infrared Spectroscopy (FTIR) and an Electrical Low-Pressure Impactor (ELPI + ). Two mitigation strategies were successfully implemented during episodes of PZ aerosol emission. These episodes resulted from the presence of SO 3 in the flue gas due to periods of sub-optimal SO 3 removal upstream of the CO 2 capture facility. Four weeks of aerosol tests were also run with 0–6 ppm of SO 3 generated and injected into the flue gas to evaluate the resilience of the mitigation strategies. The first approach to aerosol emission mitigation was to remove aerosol nuclei present in the flue gas. The second approach was to run the absorber with flue gas containing varying SO 3 at conditions that accelerate aerosol nuclei growth and collection within the packing. SO 3 control via hydrated lime addition upstream of the absorber eliminated aerosol while higher lean solvent temperature in the absorber and a two-stage water wash configuration were tested to accelerate aerosol nuclei growth and collection. Increasing the lean solvent temperature by 11 °C and using a two-stage water wash resulted in 98% reduction of PZ emissions. Absorber performance at the elevated lean solvent temperature was sustained in the existing packing with solvent intercooling. PZ emissions were managed to less than 1 ppm for extended periods during the pilot plant campaign.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2016

Calcium-based multi-element chemistry for grid-scale electrochemical energy storage

Calcium is an attractive material for the negative electrode in a rechargeable battery due to its low electronegativity (high cell voltage), double valence, earth abundance and low cost; however, the use of calcium has historically eluded researchers due to its high melting temperature, high reactivity and unfavorably high solubility in molten salts. Here we demonstrate a long-cycle-life calcium-metal-based rechargeable battery for grid-scale energy storage. By deploying a multi-cation binary electrolyte in concert with an alloyed negative electrode, calcium solubility in the electrolyte is suppressed and operating temperature is reduced. These chemical mitigation strategies also engage another element in energy storage reactions resulting in a multi-element battery. These initial results demonstrate how the synergistic effects of deploying multiple chemical mitigation strategies coupled with the relaxation of the requirement of a single itinerant ion can unlock calcium-based chemistries and produce a battery with enhanced performance.

25 ENERGY STORAGE↗

DOE OSTI2018

Perchlorate contamination in Chile: Legacy, challenges, and potential solutions

Highlights: • Perchlorate occurs naturally at high concentrations in Chile, for millions of years. • Perchlorate contaminates soils, sediments, drinking water and food products. • Trade of contaminated food products and fertilizers may affect countries worldwide. • Atacama Desert can be used as a natural laboratory for bioprospecting new bacteria. • Chile should evaluate population risks and mitigation strategies for perchlorate. This paper reviews the unique situation of perchlorate contamination in Chile, including its sources, presence in environmental media and in the human population, and possible steps to mitigate its health impacts. Perchlorate is a ubiquitous water contaminant that inhibits thyroid function. Standards for drinking water range from 2 to 18 µg L{sup −1} in United States and Europe. A major natural source of perchlorate contamination is Chile saltpeter, found in the Atacama Desert. High concentrations of perchlorate have presumably existed in this region, in soils, sediments, surface waters and groundwaters, for millions of years. As a result of this presence, and the use of Chile saltpeter as a nitrogen fertilizer, perchlorate in Chile has been found at concentrations as high as 1480 µg L{sup −1} in drinking water, 140 µg/kg{sup −1} in fruits, and 30 µg L{sup −1} in wine. Health studies in Chile have shown concentrations of 100 µg L{sup −1} in breast milk and 20 µg L{sup −1} in neonatal serum. It is important to acknowledge perchlorate as a potential health concern in Chile, and assess mitigation strategies. A more thorough survey of perchlorate in Chilean soils, sediments, surface waters, groundwaters, and food products can help better assess the risks and potentially develop standards. Also, perchlorate treatment technologies should be more closely assessed for relevance to Chile. The Atacama Desert is a unique biogeochemical environment, with millions of years of perchlorate exposure, which can be mined for novel perchlorate-reducing microorganisms, potentially leading to new biological treatment processes for perchlorate-containing waters, brines, and fertilizers.

54 ENVIRONMENTAL SCIENCES↗

DOE OSTI2020

2-D moving mesh modeling of lithium dryout in open surface liquid metal flow applications

Liquid lithium displays increasing promise as a replacement for solid plasma facing components (PFCs) in fusion device applications. The Liquid Metal Infused Trench (LiMIT) system, developed at the University of Illinois (UIUC), has demonstrated how thermoelectric magnetohydrodynamics (TEMHD) can be harnessed to drive liquid lithium flow in an open surface PFC. However, in the highest heat flux applications, large local acceleration is created via TEMHD, and the sudden increase in velocity can cause the liquid level to expose the underlying solid, eliminating the protective benefits of the lithium. In order to study potential mitigation strategies, a 2-D COMSOL Multiphysics model was developed using the moving mesh module to capture free surface flow. The model depicts the development of the dryout phenomenon for 2 test cases – slow (1 cm/s) and medium (10 cm/s) flow in 5 mm deep trenches – including the liquid level reduction under the high heat flux and the pileup of slower flow both upstream and downstream of the heat stripe. The effectiveness of trench shaping dryout mitigation strategies is examined. For the slow flow case, it is shown that a 1.8 mm ledge placed under the heat stripe will stop dryout, and for the medium flow case, a 2.7 mm ledge is required to mitigate the effect. This model can be used to identify strategies for increasing the viable heat load for open surface liquid lithium PFCs.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

DOE OSTI2022

Tradeoffs among indoor air quality, financial costs, and CO 2 emissions for HVAC operation strategies to mitigate indoor virus in U.S. office buildings

Adapting building operation during the COVID-19 pandemic to improve indoor air quality (IAQ) while ensuring sustainable solutions in terms of costs and CO 2 emissions is challenging and limited in literature. Our previous study investigated different HVAC operation strategies, including increased filtration using MERV 10, MERV 13, or HEPA filters, as well as supplying 100% outdoor air into buildings for a system initially sized for MERV 10 filtration. This paper significantly extends that research by systematically analyzing the potential financial and environmental impact for different locations in the U.S. The previous medium office building system model is improved to account for operation in different climates. New evaluation metrics are created to consider the comprehensive impact of improving IAQ on costs and CO 2 emissions, using dynamic emission factors for electricity generation depending on the location. HVAC operation strategies are studied in five different locations across the United States, with distinct climates and electricity sources. In four of the five locations, MERV 13 filtration offers the best improvement in IAQ per increase in costs and emissions relative to MERV 10. The exception is the mildest climate of San Diego, where use of 100% outdoor air provides the best IAQ with a limited increase in costs and emissions. Finally, a system not sized for HEPA filtration can lead to increased costs and emissions without much improvement in IAQ.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗

DOE OSTI2019

Understanding, Predicting, and Mitigating Catastrophic Shorts for Improved OLED Lighting Panel Reliability (Final Report)

Catastrophic OLED lighting panel failure due to electrical shorting was a significant reliability challenge facing the industry. The goal of this program was to develop a basic scientific understanding of how incipient shorts in an OLED originate and grow to a catastrophic level, and to develop mitigation strategies that enable the industry to reach the DOE target of 0.01% failure rate. We accomplished this goal, identifying the origin of shorts, understanding how the evolve over time, and ultimately identifying a mitigation strategy that was implemented by our industry partner and demonstrated to completely eliminate catastrophic shorts in production OLED panels. We identified two general classes of panel defect, termed bright spots and hot spots, that respectively originate from indium-tin-oxide agglomerations and microscale organic semiconductor dust particles on the substrate. The former are largely benign whereas the latter can lead to local shunts that grow over time and cause catastrophic failure. We understand the growth process as a self-reinforcing cycle, where shunt-induced heating volatilizes the surrounding organic semiconductor, which in turn expands the shunt and leads to even more heating. Based on these results, we identified several practical strategies to arrest the growth of early-stage shorts or prevent them entirely. These results will reduce the cost and improve the reliability of OLED lighting.

36 MATERIALS SCIENCE↗

DOE OSTI2017

Greening the Grid: Pathways to Integrate 175 Gigawatts of Renewable Energy into India's Electric Grid, Vol. II - Regional Study

The higher-spatial-resolution model of 'Greening the Grid: Pathways to Integrate 175 Gigawatts of Renewable Energy into India's Electric Grid, Vol. II - Regional Study' (the Regional Study), which better represents the impact of congestion on least-cost scheduling and dispatch, provides a deeper understanding of the relationship among renewable energy (RE) location, transmission, and system flexibility with regard to RE integration, compared to 'Greening the Grid: Pathways to Integrate 175 Gigawatts of Renewable Energy into India's Electric Grid, Vol. I - National Study.' The Regional Study validates the relative value of mitigation strategies demonstrated in the National Study - namely, coordinated operations among states reduce production costs, and reducing coal minimum generation levels reduces RE curtailment. Significantly, the Regional Study also highlights a potential barrier to realizing the value of these mitigation strategies: when locations of RE development are planned independently of state-level transmission, intrastate congestion can result in undesirable levels of RE curtailment. Therefore a key objective of this study is to illustrate to state-level power system planners and operators, in particular, how a higher-resolution model, inclusive of intrastate granularity, can be used as a planning tool for two primary purposes: -To better anticipate, understand, and mitigate system constraints that could affect RE integration; and - To provide a modeling framework that can be used as part of future transmission studies and planning efforts. The Regional Study is not intended to predict precisely how RE will affect state-level operations. There is considerable uncertainty regarding the locations of the RE development, as well as how contract terms can affect access to the inherent physical flexibility of the system. But the scenarios analyzed identify the types of issues that can arise under various RE and transmission expansion pathways. The model developed for this study provides a rigorous framework for future work and can be updated with the characteristics of new capacity as more information on the future power system is known.

24 POWER TRANSMISSION AND DISTRIBUTION↗

DOE OSTI2017

Greening the Grid: Integrating 175 Gigawatts of Renewable Energy into India's Electric Grid - A Detailed Look at the Western Region

24 POWER TRANSMISSION AND DISTRIBUTION↗

DOE OSTI2017

Greening the Grid: Integrating 175 Gigawatts of Renewable Energy into India's Electric Grid - A Detailed Look at the Southern Region

The higher-spatial-resolution model of 'Greening the Grid: Pathways to Integrate 175 Gigawatts of Renewable Energy into India's Electric Grid, Vol. II - Regional Study' (the Regional Study), which better represents the impact of congestion on least-cost scheduling and dispatch, provides a deeper understanding of the relationship among renewable energy (RE) location, transmission, and system flexibility with regard to RE integration, compared to 'Greening the Grid: Pathways to Integrate 175 Gigawatts of Renewable Energy into India's Electric Grid, Vol. I - National Study.' The Regional Study validates the relative value of mitigation strategies demonstrated in the National Study - namely, coordinated operations among states reduce production costs, and reducing coal minimum generation levels reduces RE curtailment. Significantly, the Regional Study also highlights a potential barrier to realizing the value of these mitigation strategies: when locations of RE development are planned independently of state-level transmission, intrastate congestion can result in undesirable levels of RE curtailment. Therefore a key objective of this study is to illustrate to state-level power system planners and operators, in particular, how a higher-resolution model, inclusive of intrastate granularity, can be used as a planning tool for two primary purposes: to better anticipate, understand, and mitigate system constraints that could affect RE integration; and to provide a modeling framework that can be used as part of future transmission studies and planning efforts. The Regional Study is not intended to predict precisely how RE will affect state-level operations. There is considerable uncertainty regarding the locations of the RE development, as well as how contract terms can affect access to the inherent physical flexibility of the system. But the scenarios analyzed identify the types of issues that can arise under various RE and transmission expansion pathways. The model developed for this study provides a rigorous framework for future work and can be updated with the characteristics of new capacity as more information on the future power system is known.

24 POWER TRANSMISSION AND DISTRIBUTION↗