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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 109 records · Page 6

Ion Gating in Nanopore Electrode Arrays with Hierarchically Organized pH-Responsive Block Copolymer Membranes

Inspired by biological ion channels, artificial nanopore-based architectures have been developed for smart ion/molecular transport control with potential applications to iontronics and energy conversion. Advances in nanofabrication technology enable simple, versatile construction methods, and post-fabrication functionalization delivers nanochannels with unique ion transport-control attributes. Here, we characterize a pH-responsive, charge-selective dual-gating block copolymer (BCP) membrane composed of polystyrene-b-poly(4-vinylpyridine) (PS 48400 -b-P4VP 21300 ), capable of self-organizing into highly ordered nanocylindrical domains. Because the PS-b-P4VP membrane exhibits pH-dependent structural transitions, it is suitable for designing intelligent pH-gated biomimetic channels, for example, exhibiting on–off transport switching at pH values near the pK a of P4VP with excellent anion permselectivity at pH < pK a . Introducing the BCP membrane onto nanopore electrode arrays (BCP@NEAs) allows the BCP to serve as a pH-responsive gate controlling ion transfer into the NEA nanopores. Such selectively transported and confined ions are detected by using a 100 nm gap dual-ring nanoelectrode structure capable of enhancing current output by efficient redox cycling with an amplification factor >10 2 . In addition, BCP@NEAs exhibit extraordinary pH-gated ion selectivity, resulting in a 3380-fold current difference between anion and cation probes at pH 3.0. Furthermore, this hierarchically organized BCP-gated NEA system can serve as a template for the development of other stimulus-responsive ion gates, for example, those based on temperature and ligand gating, thus exploiting the intrinsic advantages of NEAs, such as enhanced sensitivity based on redox cycling, which may lead to technological applications such as engineered biosensors and iontronic devices.

36 MATERIALS SCIENCE↗

Prolate and oblate chiral liquid crystal spheroids

Liquid crystals are known to exhibit intriguing textures and color patterns, with applications in display and optical technologies. This work focuses on chiral materials and examines the palette of morphologies that arises when microdroplets are deformed into nonspherical shapes in a controllable manner. Specifically, geometrical confinement and mechanical strain are used to manipulate orientational order, phase transitions, and topological defects that arise in chiral liquid crystal droplets. Inspired by processes encountered in nature, where insects and animals often rely on strain and temperature to alter the optical appearance of dispersed liquid crystalline elements, chiral droplets are dispersed in polymer films and deformation induced by uniaxial or biaxial stretching. Our measurements are interpreted by resorting to simulations of the corresponding systems, thereby providing an in-depth understanding of the morphologies that arise in these materials. The reported structures and assemblies offer potential for applications in smart coatings, smart fabrics, and wearable sensors.

42 ENGINEERING↗

Validation of a Co-Optimized, Smart Hybrid Heat Pump Control

This study examines a residential dual fuel (DF) heating system that integrates heat pump and gas furnace technology with a home’s forced-air distribution ducts. Specifically, it explores a retrofit where an “add-on” heat pump replaces the air conditioning (A/C) system and is combined with the home’s existing furnace and air handler. The research team developed and validated an innovative control scheme for this integrated DF system that selected the more economical heating source (furnace or heat pump) while maintaining comfort in the home. The project’s field study and subsequent modeling analysis show that this control scheme can decrease energy use, cost, and emissions compared to a furnace-only system. As homes in mixed and cold climates transition to more electric space heating, furnace-to-dual fuel system retrofits offer a solution that can alleviate the retrofit costs, energy cost concerns, and peak load impacts of full electrification.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

Conformer-Dependent Chemistry: Experimental Product Branching of the Vinyl Alcohol + OH + O 2 Reaction

The concentration of formic acid in Earth's tropo-sphere is underestimated by detailed chemical models compared to field observations. Phototautomerization of acetaldehyde to its less stable tautomer vinyl alcohol, followed by the OH-initiated oxidation of vinyl alcohol, has been proposed as a missing source of formic acid that improves the agreement between models and field measurements. Theoretical investigations of the OH + vinyl alcohol reaction in excess O 2 conclude that OH addition to the alpha carbon of vinyl alcohol produces formaldehyde + formic acid + OH, whereas OH addition to the β site leads to glycoaldehyde + HO 2 . Furthermore, these studies predict that the conformeric structure of vinyl alcohol controls the reaction pathway, with the anti-conformer of vinyl alcohol promoting α OH addition, whereas the syn-conformer promotes β addition. However, the two theoretical studies reach different conclusions regarding which set of products dominate. We studied this reaction using time-resolved multiplexed photoionization mass spectrometry to quantify the product branching fractions. Our results, supported by a detailed kinetic model, conclude that the glycoaldehyde product channel (arising mostly from syn-vinyl alcohol) dominates over formic acid production with a 3.6:1.0 branching ratio. Additionally, this result supports the conclusion of Lei et al. that conformer-dependent hydrogen bonding at the transition state for OH-addition controls the reaction outcome. As a result, tropospheric oxidation of vinyl alcohol creates less formic acid than recently thought, increasing again the discrepancy between models and field observations of Earth's formic acid budget.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Dynamic Line Rating Models and Their Potential for a Cost‐Effective Transition to Carbon‐Neutral Power Systems

Most transmission system operators (TSOs) currently use seasonally steady-state models considering limiting weather conditions that serve as reference to compute the transmission capacity of overhead power lines. The use of dynamic line rating (DLR) models can avoid the construction of new lines, market splitting, false congestions, and the degradation of lines in a cost-effective way. DLR can also be used in the long run in grid extension and new power capacity planning. In the short run, it should be used to help operate power systems with congested lines. The operation of the power systems is planned to have the market trading into account; thus, it computes transactions hours ahead of real-time operation, using power flow forecasts affected by large errors. In the near future, within a “smart grid” environment, in real-time operation conditions, TSOs should be able to rapidly compute the capacity rating of overhead lines using DLR models and the most reliable weather information, forecasts, and line measurements, avoiding the current steady-state approach that, in many circumstances, assumes ampacities above the thermal limits of the lines. Here, this work presents a review of the line rating methodologies in several European countries and the United States. Furthermore, it presents the results of pilot projects and studies considering the application of DLR in overhead power lines, obtaining significant reductions in the congestion of internal networks and cross-border transmission lines.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗

Distributed Wind-Hybrid Microgrids with Autonomous Controls and Forecasting

Distributed wind-hybrid microgrids have the potential to provide key resilience and economic benefits to both the customers they serve and the utility grids they are connected to. Such microgrids will likely be a key part of the grid of the future, whether connected to large utility grids or linked together in multi-microgrid systems. Through the hybridization of distributed wind and solar photovoltaics, autonomous device-level and system-level controls, battery energy storage systems with smart inverters, and forecasting, these microgrids could maintain local stability and provide grid services - all with renewable power. In the literature, these elements have been considered individually. However, they have not been combined and demonstrated at a high fidelity, which is essential to prove the concept's operation before moving to hardware-in-the-loop and physical demonstrations. In this work, we develop a high-fidelity MATLAB-Simulink model of a real distributed wind-hybrid microgrid that includes all these elements. We demonstrate the microgrid maintaining stability and production in a variety of islanded, grid-connected, and transition scenarios. This includes riding through faults and grid transitions, handling resource variability, and providing grid services. The results demonstrate, at a high fidelity, how distributed wind-hybrid microgrids can operate in an economic and resilient fashion. Finally, we provide recommendations for future research to move advanced distributed wind-hybrid microgrids toward deployment.

ancillary services↗

Managing Cyber Supply Chain Risk for Renewable Energy Technologies

On July 1, 2021, the U.S. Department of Energy (DOE) Office of Cybersecurity, Energy Security, and Emergency Response (CESER) hosted a virtual workshop facilitated by the National Renewable Energy Laboratory (NREL). Cybersecurity supply chain experts, researchers, and leaders in government and industry came together to share information on current and future challenges in securing emerging technologies and technical architecture. From a cybersecurity perspective, we need to move from a cybersecurity approach that focuses principally on legacy asset owners to one that incorporates more emphasis on end-point device manufacturers and third-party integrators. Cybersecurity for the global digital supply chain for manufacturers of consumer end-point devices—such as smart solar inverters and smart electric vehicle (EV) chargers—will be critical to the future cyber health of the grid.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗

Model-based Design Optimization to Achieve the Performance Goals (16.0 SEER/9.5 HSPF), Developing Heat Pump by Using Low-GWP Refrigerants and 5 mm Diameter Tubes

Usage of low-GWP refrigerants can reduce the Green House Gas (GHG) emission of HVAC systems. Our research in previous milestone report has shown that using heat exchangers with 5 mm diameter tubes instead of 9 mm diameter tubes is a promising solution to meet the performance goals of heat pump using low-GWP refrigerants. In addition, the 5mm tube heat exchangers can lead to lower system refrigerant charge and as a result, reduce environmental impact further. However, shifting to small tube diameters requires in-depth heat exchanger design optimization to adapt to the transition to low-GWP refrigerants. In the 2nd quarter of FY21, we conducted multi-objective optimizations using Particle Swarm Optimization algorithm on a residential 5-ton air source heat pump to investigate the potential system performance improvements and material savings. 4 low-GWP refrigerants, ARM20A, ARM20B, R454A and R454C are investigated in this study. The objectives of the optimization are to minimize the heat pump material cost and to maximize the system performance simultaneously. As a result, the HXs material cost is reduced by up to 77% according to the copper and aluminum material price in current market. Under heating mode operation, the smart 4-way valve guarantees that the optimal low-GWP systems maintain or outperform the heating performance of the R410A baseline system. The model-based design optimization yields 18.3-18.9 SEER and 10.6-11.9 HSPF for optimal systems using different low-GWP refrigerants. The initial performance goals (16.0 SEER/9.5 HSPF) are achieved. Furthermore, up to 50% system refrigerant charge reduction is possible in the optimized low-GWP heat pump system using ARM20B. And 91%-95% predicted life-time direct CO 2 emission reduction is achieved by using the optimal 5mm tube low-GWP heat pumps. The significant material saving, charge reduction and direct CO 2 emission reduction help in reducing the environmental impacts of heat pump systems. The optimal heat exchangers resulting from this research can fit into the original baseline indoor and outdoor fan-coil unit. This can reduce the retrofitting effort by minimizing the change in manufacturing and installation of the heat pumps and guarantee the compatibility with end-users’ house structure. Finally, the new products can be easily accepted by manufacturers and end-users.

42 ENGINEERING↗

Incentivizing Distributed Energy Resource Participation in Grid Services

The bulk power system is experiencing a dramatic shift as renewable generation growth continues to accelerate. Large-scale renewables adoption will help societies transition to a low-carbon, low-cost, and environmentally friendly electrical power system. However, the transition from a paradigm of generation following load to one where load follows generation will require large-scale interconnection and coordinated operation of Distributed Energy Resources (DERs), supported by open communication protocols. In this future grid scenario, DER aggregations will provide critical grid services that enable high penetration levels of renewable generation. This position paper presents an Energy Service Interface (ESI) that defines scope for ensuring secure, trustworthy information exchange between grid service providers and DERs. The goal of the ESI is to encourage large-scale participation of DERs in order to provide grid services through dispatch of DER aggregations. This position paper also presents an open smart energy communications protocol that allows DERs to advertise their characteristics and participate in grid services, within constraints established by the ESI. The paper presents several monetization incentives that grid service providers could use to encourage large-scale DER participation.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

Combined Experimental and Theoretical Investigations of n-Type BiFeO 3 for Use as a Photoanode in a Photoelectrochemical Cell

Combined experimental and theoretical investigations were performed to evaluate the potential of n-type BiFeO 3 as a photoanode. While previous experimental and theoretical studies on BiFeO 3 mainly focused on its ferroelectric properties, several studies have reported the advantages of BiFeO 3 as a photoelectrode for solar water splitting (e.g. bandgap energy and band edge positions relative to water reduction and oxidation potentials). However, the photoelectrochemical properties of n-type BiFeO 3 have not yet been thoroughly investigated. In our experimental investigation, we developed an electrodeposition-based synthesis to prepare uniform n-type BiFeO 3 thin-film electrodes. Furthermore, using a heat treatment under a N 2 environment, we intentionally introduced additional oxygen vacancies into the pristine n-type BiFeO 3 electrodes to increase the majority carrier density. The bandgaps, flatband potentials, photocurrent onset potentials, photocurrent generation, and photoelectrochemical stabilities of the pristine and N 2 -treated BiFeO 3 photoanodes were investigated comparatively to improve our understanding of BiFeO 3 photoanodes and to examine the effect of oxygen vacancies on the photoelectrochemical properties of BiFeO 3 . In our theoretical investigation, we performed first-principles calculations and demonstrated the formation of a small polaron when an extra electron was introduced into the BiFeO 3 lattice. Changes in electronic states cause by the small polaron formation were carefully investigated. We also examined the effects of oxygen vacancies on electron polaron formation and carrier concentration in BiFeO 3 . Using charge formation energy calculations and referencing charge transition levels to the free electron polaron level instead of to the conduction band minimum, we showed that the oxygen vacancy is capable of serving as a donor to enhance the carrier concentration of BiFeO 3 . Furthermore, our theoretical results agree well with our experimental findings. Together, the new experimental and theoretical results and discussion provided in this study have considerably improved our understanding of n-type BiFeO 3 as a photoanode.

25 ENERGY STORAGE↗

Physical, socio-psychological, and behavioural determinants of household energy consumption in the UK

Determining which attitudes and behaviours predict household energy consumption can help accelerate the low-carbon energy transition. Conventional approaches in this domain are limited, often relying on survey methods that produce data on individuals’ motivations and self-reported activities without pairing these with actual energy consumption records, which are particularly hard to collect for large, nationally representative samples. This challenge precludes the development of empirical evidence on which attitudes and behaviours influence patterns of energy consumption, thus limiting the extent to which these can inform energy interventions or conservation programs. This study demonstrates a novel methodology for estimating energy consumption in the absence of actual energy records by using a large, publicly available data set of energy consumption in the UK. We develop a predictive model using the Smart Energy Research Laboratory (SERL) data portal (with records from nearly 13,000 UK households) and then use this model to predict energy consumption (both electric and gas) for a sample of 1,000 UK householders for which we separately collect over 200 variables relating to climate change attitudes and practices. Our approach uses a set of over 50 independent variables that are shared between the data sets, allowing us to train a model on the SERL data and use it to analyse the relationship between energy consumption and the opinions, motivations, and daily practices of survey respondents. Results show that electricity consumption is influenced by a broader range of factors compared to gas. Household energy use is best explained by physical dwelling characteristics, socio-demographic variables, and certain behavioural and attitudinal measures. Notably, pro-environmental attitudes, frugality, and conscientiousness correlate with lower energy use, while income and consumerism are linked to higher consumption. We discuss how these findings can inform efforts to decarbonise home energy use in the UK.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

Dual-Band Electrochromism in Hydrous Tungsten Oxide

The independent modulation of visible and near-infrared light by a single material, termed dualband electrochromism, is highly desirable for smart windows to enhance the energy efficiency of buildings. Tungsten oxides are commercially important electrochromic materials, exhibiting reversible visible and near-infrared absorption when electrochemically reduced in an electrolyte containing small cations or protons. The presence of structural water in tungsten oxides has been associated with faster electrochromic switching speeds. Here, we find that WO 3 ·H 2 O, a crystalline hydrate, exhibits dual-band electrochromism unlike the anhydrous WO 3 providing a heretofore unexplored route to tune the electrochromic response of tungsten oxides. Absorption of near-infrared light is achieved at low Li + /e - injection, followed by the absorption of visible light at higher Li + /e - injection as a result of an electrochemically-induced phase transition. We propose that this dual-band modulation is possible due to the more open structure of WO 3 ·H 2 O as compared to WO 3 . This facilitates a more extended solid solution Li + insertion regime that benefits the modulation of near-infrared radiation via plasmon absorption. Higher degrees of Li + /e - insertion lead to polaronic absorption associated with localized charge storage. Furthermore, these results inform how structural factors influence the electrochemically induced spectral response of transition metal oxides and the important role of structural water beyond optical switching speed.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

Ion-Conducting Thermoresponsive Films Based on Polymer-Grafted Cellulose Nanocrystals

Mechanically robust, thermo-responsive, ion-conducting nanocomposite films are prepared from poly(2-phenylethyl methacrylate) grafted cellulose nanocrystals (MxG-CNC-g-PPMA). One-component nanocomposite films of the polymer grafted nanoparticle (PGN) MxG-CNC-g-PPMA are imbibed with 30 wt% imidazolium-based ionic liquid, to produce flexible ion-conducting films. These films with 1-hexyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide (MxG-CNC-g-PPMA/[H]) not only displays remarkable improvements in toughness (>25 times) and tensile strength (>70 times) relative to the corresponding nanocomposites consisting of the ionic liquid imbibed in the two component CNC/PPMA nanocomposite, but also shows higher ionic conductivity than the corresponding neat PPMA with the same wt.% of ionic liquid. Notably, the one-component film containing 1-ethyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide (MxG-CNC-g-PPMA/[E]) exhibits temperature responsive ionic conduction. The ionic conductivity decreases at around 60°C as a consequence of the lower critical solution temperature (LCST) phase transition of the grafted polymer in the ionic liquid, which leads to phase separation. Moreover, holding the MxG-CNC-g-PPMA/[E] film at room temperature for 24 hours returns the film to its original homogenous state. These materials exhibit properties relevant to thermal cutoff safety devices (e.g., thermal fuse) where a reduction in conductivity above a critical temperature is needed.

36 MATERIALS SCIENCE↗

Measuring Flexibility through Reduction Potential

As electrical loads, electric vehicles (EVs) are distinguished in many cases by their substantial flexibility. Harnessing this flexibility, however, requires a precise characterization of its timing and degree. Current approaches to flexibility characterization tend to be limited either by the complexity of their representation or their inability to capture aggregate flexibility across multiple vehicles. In this paper, we present the reduction potential matrix, a novel metric capturing fleet-level EV load flexibility while being both straightforward to calculate and intuitive to interpret. We use the metric to quantify flexibility for two operationally distinct commercial groups: freight vehicles and transit buses. While we find that both vehicle groups have substantial flexibility, its timing, magnitude, and duration varies across the groups. We describe how this variability translates into variation in the each group's role as a grid resource, and conclude with a discussion of how system planners, fleet operators, and other stakeholders can use the novel metric to cultivate symbiosis between vehicles and the grid.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

RADIANCE Cybersecurity Plan: Generic Version

Under its Grid Modernization Initiative, the U.S. Department of Energy (DOE), in collaboration with energy industry stakeholders developed a multi-year research plan to support modernizing the electric grid. One of the foundational projects for accelerating modernization efforts is information and communications technology interoperability. A key element of this project has been the development of a methodology for engaging ecosystems related to grid integration to create roadmaps that advance the ease of integration of related smart technology. This document is the product of activities undertaken in 2017 through 2019. It provides a Cybersecurity Plan describing the technology to be adopted in the project with details as per the GMLC Call document.

24 POWER TRANSMISSION AND DISTRIBUTION↗

Scaling Up metal additive manufacturing process to fabricate molds for composite manufacturing

Direct Energy Deposition (DED) systems are currently used to repair and maintain existing parts in the aerospace and automotive industries. This paper discusses an effort to scale up the DED technique in order to Additively Manufacture (AM) molds and dies used in the composite manufacturing industry. The US molds and dies market has been in a rapid decline over the last decade due to outsourcing to non-US entities. Oak Ridge National Laboratory (ORNL), Wolf Robotics and Lincoln Electric have developed a Metal Big Area Additive Manufacturing (MBAAM) system that uses a high deposition rate and a low-cost wire feedstock material. In this work we used the MBAAM system with a mild steel wire, ER70S-6, to fabricate a compression molding mold for composite structures used in automotive and mass-transit applications. In addition, the mechanical properties of the AM structure were investigated, and it was found that the MBAAM process delivers parts with high planar isotropic behavior. The paper investigates the microstructure and grain of the printed articles to confirm the roots of the observed planar isotropic properties. Here, the manufactured AM mold was used to fabricate 50 composite parts with no observed mold deformations.

36 MATERIALS SCIENCE↗

Heterogeneity and Hysteresis in the Polymer Collapse of Single Core–Shell Stimuli-Responsive Plasmonic Nanohybrids

Broad application of polymeric stimuli-responsive smart nanohybrids requires understanding the mechanisms governing active control. Ensemble techniques have identified inhomogeneous polymer collapse in microgels that potentially arise from heterogeneous interchain interactions and differences in core size. A single-particle examination would establish the influence of core size and internal polymer network heterogeneity on local interactions that contribute to the observed inhomogeneous polymer collapse dynamics of nanohybrids. Using single-particle dark-field spectroscopy, we investigated the complex polymer collapse profiles of core–shell plasmonic nanohybrids comprising thermoresponsive poly(N-isopropylacrylamide) (pNIPAM)-encapsulated gold nanorods (AuNRs). We report that the polymer collapse behavior was independent of the core size. For thinner polymer shells, we observed hysteresis in the collapse of AuNR@pNIPAMs, likely related to local pNIPAM aggregation due to interchain hydrogen bonding. For thicker polymer shells, we observed a broad polymer collapse distribution that we attributed to a two-step phase transition that arises from a polymer network density gradient. Furthermore, our single-particle approach relates the internal heterogeneity of the polymer network of nanohybrids to the mechanisms underlying heterogeneous phase transitions that traditional, ensemble-averaged approaches are unable to discern.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

Measuring Mobility Potential: A Novel Metric to Quantify Mobility Energy Productivity (MEP) of Transportation Systems

For nearly a century, the automobile has been the primary mode of personal transportation in American life. This remains true today as millions of people rely heavily on cars to connect suburbs with cities or to travel long distances - often out of routine or convenience. However, advances in technology are fueling an era of transportation transformation, with the potential to transform a system that has remained virtually unchanged for decades. The challenges of interconnecting our cities and creating a cross-continental transportation system for military purposes spawned the interstate highway system, generating the age of the automobile. In this century, congestion and mobility challenges of rising urban populations are spawning ever-evolving mobility and communications technologies to connect people to goods, services, and employment within a metropolitan and national context - all of which define a high quality of life. Aspiring smart cities are wrestling with questions such as: How does mobility impact a person's quality of life? Would people make different travel choices if they were presented with better information about their mobility options? Would businesses make different location decisions if they could assess the quality of mobility in that area? The ability to quantify the quality of mobility at a given location is the first step toward answering these questions. In response, an interdisciplinary team at the National Renewable Energy Laboratory (NREL) has developed the Mobility-Energy Productivity (MEP) metric. The MEP metric provides an avenue to not only measure the quality of mobility at a specific location in its current configuration, but also to test how various technological advances (e.g., connected and automated vehicles, plug-in electric vehicles, shared mobility) and infrastructure investments (e.g., building an additional highway lane, constructing a new shopping mall, implementing a transit-oriented development) impact the mobility of that location over time.

30 DIRECT ENERGY CONVERSION↗