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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 19 records

Critical steps in preventing future pandemics. Early lessons from the Covid-19 crisis for addressing natural and deliberate biological threats.

This report summarizes a virtual workshop on early lessons from the COVID-19 pandemic as they pertain to proactively addressing future biological threats. Co-hosted by Sandia National Laboratory (Sandia) and the Council on Strategic Risks (CSR) in August 2020, the discussion involved experts who at that time were leading innovative efforts in various U.S. government agencies, industry, and academia sharing observations from their ongoing pandemic response efforts. Based on the input by these expert participants, it is clear that even though the pandemic response is ongoing, the following recommendations will be important to consider for more successfully addressing biological threats in the future: Continue building on the cross-sector collaboration and agility shown in the COVID-19 response; Expand capabilities for detecting biological threats early; Prioritize ways to create and disseminate medical countermeasures even faster; Create the U.S. bio industrial base needed for rapid response to biological threats, and keep it healthy; and, Major government reorganization may not be needed if there is effective work to form coalitions, improve coordination, and expand steady-state and surge capacities.

29 ENERGY PLANNING, POLICY, AND ECONOMY↗

Towards a Mars base - Critical steps for life support on the moon and beyond

In providing crew life support for future exploration missions, overall exploration objectives will drive the life support solutions selected. Crew size, mission tasking, and exploration strategy will determine the performance required from life support systems. Human performance requirements, for example, may be offset by the availability of robotic assistance. Once established, exploration requirements for life support will be weighed against the financial and technical risks of developing new technologies and systems. Other considerations will include the demands that a particular life support strategy will make on planetary surface site selection, and the availability of precursor mission data to support EVA and in situ resource recovery planning. As space exploration progresses, the diversity of life support solutions that are implemented is bound to increase.

Rummel, John D.↗

Geometries for roughness shapes in laminar flow

A passive interface mechanism between upper and lower skin structures, and a leading edge structure of a laminar flow airfoil is described. The interface mechanism takes many shapes. All are designed to be different than the sharp orthogonal arrangement prevalent in the prior art. The shapes of the interface structures are generally of two types: steps away from the centerline of the airfoil with a sloping surface directed toward the trailing edge and, the other design has a gap before the sloping surface. By properly shaping the step, the critical step height is increased by more than 50% over the orthogonal edged step.

Holmes, Bruce J.↗

The Effect of Forward-Facing Steps on Stationary Crossflow Instability Growth and Breakdown

The effect of a forward-facing step on stationary crossflow transition was studied using standard stereo particle image velocimetry (PIV) and time-resolved PIV. Step heights ranging from 53 to 71% of the boundary-layer thickness were studied in detail. The steps above a critical step height of approximately 60% of the boundary-layer thickness had a significant impact on the stationary crossflow growth downstream of the step. For the critical cases, the stationary crossflow amplitude grew suddenly downstream of the step, decayed for a short region, then grew again. The adverse pressure gradient upstream of the step resulted in a region of crossflow reversal. A secondary set of vortices, rotating in the opposite direction to the primary vortices, developed underneath the uplifted primary vortices. The wall-normal velocity disturbance (V' ) created by these secondary vortices impacted the step, and is believed to feed into the strong vortex that developed downstream of the step. A large but very short negative crossflow region formed for a short region downstream of the step due to a sharp inboard curvature of the streamlines near the wall. For the larger step height cases, a crossflow-reversal region formed just downstream of the strong negative crossflow region. This crossflow reversal region is believed to play an important role in the growth of the stationary crossflow vortices downstream of the step, and may be a good indication of the critical forward-facing step height.

Eppink, Jenna L.↗

Mechanisms of Stationary Crossflow Instability Growth and Breakdown Induced by Forward-Facing Steps

An experimental study is performed to determine the mechanisms by which a forward-facing step impacts the growth and breakdown to turbulence of the stationary cross-flow instability. Particle image velocimetry measurements are obtained in the boundary layer of a 30◦swept flat plate with a pressure body. Step heights range from 53 % to 71 % of the boundary-layer thickness. The critical step height is approximately 60 % of the boundary-layer thickness for the current study, although it is also shown that the critical step height depends on the initial amplitude of the stationary cross-flow vortices. For the critical cases, the stationary cross-flow amplitude grows sharply downstream of the step, decays for a short region and then grows again. The initial growth region is linear, and can be explained primarily through the impact of the step on the mean flow. Namely, the step causes abrupt changes to the mean flow, resulting in large values of wall-normal shear, as well as highly inflectional profiles, due to either cross-flow reversal, separation or both. These inflectional profiles are highly unstable for the stationary cross-flow. Additionally,the reversed flow regions are significantly modulated by the stationary cross-flow vortices. The second region of growth occurs due to the stationary-cross-flow-induced modulation of the shear layer, which leads to multiple smaller wavelength stream wise vortices. High-frequency fluctuations indicate that the unsteady transition mechanism for the critical cases relates to the shedding of vortices downstream of reattachment of the modulated separated regions.

boundary layer stability↗

Turbulent flow past a backward-facing step - A critical evaluation of two-equation models

The ability of two-equation models to accurately predict separated flows is analyzed from a combined theoretical and computational standpoint. Turbulent flow past a backward facing step is chosen as a test case in an effort to resolve the variety of conflicting results that were published during the past decade concerning the performance of two-equation models. It is found that the errors in the reported predictions of the k-epsilon model have two major origins: (1) numerical problems arising from inadequate resolution, and (2) inaccurate predictions for normal Reynolds stress differences arising from the use of an isotropic eddy viscosity. Inadequacies in near wall modelling play a substantially smaller role. Detailed calculations are presented which strongly indicate the standard k-epsilon model - when modified with an independently calibrated anisotropic eddy viscosity - can yield surprisingly good predictions for the backstep problem.

Thangam, S.↗

Turbulent separated flow past a backward-facing step: A critical evaluation of two-equation turbulence models

The ability of two-equation models to accurately predict separated flows is analyzed from a combined theoretical and computational standpoint. Turbulent flow past a backward facing step is chosen as a test case in an effort to resolve the variety of conflicting results that were published during the past decade concerning the performance of two-equation models. It is found that the errors in the reported predictions of the k-epsilon model have two major origins: (1) numerical problems arising from inadequate resolution, and (2) inaccurate predictions for normal Reynolds stress differences arising from the use of an isotropic eddy viscosity. Inadequacies in near wall modelling play a substantially smaller role. Detailed calculations are presented which strongly indicate the standard k-epsilon model - when modified with an independently calibrated anisotropic eddy viscosity - can yield surprisingly good predictions for the backstep problem.

Thangam, S.↗

Methanol carbonylation to acetaldehyde on Au particles supported by single-layer MoS 2 grown on silica

Homogenous single-layer MoS 2 films coated with sub-single layer amounts of gold are found to isolate the reaction of methanol with carbon monoxide, the fundamental step toward higher alcohols, from an array of possible surface reactions. Active surfaces were prepared from homogenous single-layer MoS 2 films coated with sub-single layer amounts of gold. These gold atoms formed clusters on the MoS2 surface. A gas mixture of carbon monoxide (CO) and methanol (CH 3 OH) was partially converted to acetaldehyde (CH 3 CHO) under mild process conditions (308 kPa and 393 K). This carbonylation of methanol to a C 2 species is a critical step toward the formation of higher alcohols. Density functional theory modeling of critical steps of the catalytic process identify a viable reaction pathway. Imaging and spectroscopic methods revealed that the single layer of MoS 2 facilitated formation of nanoscale gold islands, which appear to sinter through Ostwald ripening. Here, the formation of acetaldehyde by the catalytic carbonylation of methanol over supported gold clusters is an important step toward realizing controlled production of useful molecules from low carbon-count precursors.

2D catalyst↗

Systems analysis - Key to NASA's data system planning

Critical steps in the systems analysis process for NASA's data system planning are: (1) compilation of future user/mission requirements, (2) development of alternative overall data system concepts which satisfy requirements, (3) assessment of future development and availability of data system technology, and (4) cost/performance tradeoff studies of the alternative concepts for systems optimization. Tasks within the NEEDS (NASA End-to-End Data System) Program, which correspond to the critical steps in this systems analysis process are examined.

Nelson, R. W.↗

A holistic framework integrating plant-microbe-mineral regulation of soil bioavailable nitrogen

Abstract Soil organic nitrogen (N) is a critical resource for plants and microbes, but the processes that govern its cycle are not well-described. To promote a holistic understanding of soil N dynamics, we need an integrated model that links soil organic matter (SOM) cycling to bioavailable N in both unmanaged and managed landscapes, including agroecosystems. We present a framework that unifies recent conceptual advances in our understanding of three critical steps in bioavailable N cycling: organic N (ON) depolymerization and solubilization; bioavailable N sorption and desorption on mineral surfaces; and microbial ON turnover including assimilation, mineralization, and the recycling of microbial products. Consideration of the balance between these processes provides insight into the sources, sinks, and flux rates of bioavailable N. By accounting for interactions among the biological, physical, and chemical controls over ON and its availability to plants and microbes, our conceptual model unifies complex mechanisms of ON transformation in a concrete conceptual framework that is amenable to experimental testing and translates into ideas for new management practices. This framework will allow researchers and practitioners to use common measurements of particulate organic matter (POM) and mineral-associated organic matter (MAOM) to design strategic organic N-cycle interventions that optimize ecosystem productivity and minimize environmental N loss.

Environmental Sciences & Ecology↗

Risk Analysis for Remote Operation of Microreactors

Microreactors are a subset of advanced nuclear reactors that can be factory fabricated, transportable, and self-regulating. They have the potential to be used in microgrids, rural and remote areas, or emergency response applications, replacing fossil fuel sources like diesel generators and enabling sustainable energy generation. In order to make microreactor operation cost-effective, it is likely that remote communications will be needed to reduce the number of personnel required to be on site. While remote operation of energy generation and other industrial control systems is common in other industries, it is not yet adopted in the nuclear community and has many perceived and actual risks. In this paper, the severity of the risks introduced by remote operations for microreactors are explored. The primary changes in the operations involve the addition of a remote communications network and a certification system for data and controls. These changes lend themselves to considerations of cyber risks, whether unintentional or adversarial, but the assessment considers not just cyber risks introduced, but also how physical and human factors-based risks will impact the remote operations system and change the overall risk profile. This initial assessment indicates that there are standard cyber and mitigation measures that can be put in place so the risk of doing remote operations does not dramatically increase compared to local operations. This evaluation is a critical step in the process of evaluating if remote operations of microreactors is a suitable solution to meet future sustainable grid needs

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

A Highly Effective Polysulfide-Trapping Approach for the Development of High Energy Density, Scalable Lithium-Sulfur Batteries

Lithium-sulfur (Li-S) batteries are identified as one of the most promising next-generation battery technologies owing to their high theoretical specific energy, sustainability, and affordability. However, the commercialization of Li-S batteries has been hindered by severe technical challenges, including the lithium polysulfide (PS) dissolution/shuttling effect, a major cause of fast capacity degradation over cycling. We demonstrated that, for the first time, nanolayer polymer coated high surface area porous carbons (NPCs) were coated directly on sulfur electrodes (NPC-S), which led to a high specific capacity of ∼1,600 mAh g −1 approaching the theoretical specific capacity limit in the NPC-S based Li-S batteries. The NPC-S based Li-S batteries maintained their large initial specific capacity gain compared with the Baseline-S based Li-S batteries (control) over extended cycles. A follow-on study indicated that the NPC-S approach is a necessary and critical step to boost the near-theoretical specific capacity while being stabilized over long cycles with a synergistic strategy. Our experimental and computational results suggest that NPC coated on sulfur electrodes provides not only an effective and strong PS-trapping power but also an increased redox reaction kinetics for sulfur ↔ PS’s conversions during battery charge and discharge, rendering the realization of near-theoretical discharge specific capacity in the NPC-S based Li-S batteries. The findings presented in this study may inspire a new, simple, low-cost, and commercially scalable approach, without adding any appreciable dead weight or volume to the batteries, in the effort to tackle the technical challenges facing SOA Li-S batteries.

25 ENERGY STORAGE↗

Quantitative Determination of Biomass-derived Renewable Carbon in Fuels from Coprocessing of Bio-oils in Refinery Using a Stable Carbon Isotopic Approach

Increasing renewable carbon incorporation into conventional fuels through coprocessing with vacuum gas oil (VGO, a petroleum refining feedstock) is a critical step in biofuels development, scaling-up, adoption and associated GHG reduction. Optimization of the co-processing parameters maximizes incorporation of the renewable carbon in the fuel products. Quantitative determination of the renewable carbon content in the co-processed products provides direct evaluation of the parameters. The co-processing bio-oil with VGO through hydrocracking (HC) or fluid catalytic cracking (FCC) system resulted in carbon isotopic fractionation that prevented the direct use of the isotope mixing model for quantifying the renewable carbon. Here, we report an algorithm of using a stable carbon isotope approach to quantify the renewable carbon content in co-processing biofuel products through high-precision ?13C analysis. A controlled experiment carried out by blending a fossil diesel (-29.013‰) with a bio-diesel (-30.099‰) at various blending levels up to 98.0/2.0 wt% is presented and has demonstrated the applicability of this approach. The carbon isotope fractionation factors for the bio-oil co-processing were obtained by using a 14C-derived isotope-mixing model. The ?13C method was tested by co-processing 13C-labeled bio-crude and natural woody biomass-derived fast pyrolysis (FP) and catalytic fast pyrolysis (CFP) bio-oils with VGO. The results were verified by 14C accelerator mass spectrometry (AMS) method (ASTM-D6866) and compared with the yield mass balance (YMB) method. Strong agreement between d13C and 14C AMS methods demonstrated the applicability of the ?13C method to quantify renewable carbon content in co-processing fuel products and guide the co-processing optimization

Li, Zhenghua↗

Polymer informatics: Current status and critical next steps

Artificial intelligence (AI) based approaches are beginning to impact several domains of human life, science and technology. Polymer informatics is one such domain where AI and machine learning (ML) tools are being used in the efficient development, design and discovery of polymers. Surrogate models are trained on available polymer data for instant property prediction, allowing screening of promising polymer candidates with specific target property requirements. Questions regarding synthesizability, and potential (retro)synthesis steps to create a target polymer, are being explored using statistical means. Data-driven strategies to tackle unique challenges resulting from the extraordinary chemical and physical diversity of polymers at small and large scales are being explored. Other major hurdles for polymer informatics are the lack of widespread availability of curated and organized data, and approaches to create machine-readable representations that capture not just the structure of complex polymeric situations but also synthesis and processing conditions. Methods to solve inverse problems, wherein polymer recommendations are made using advanced AI algorithms that meet application targets, are being investigated. As various parts of the burgeoning polymer informatics ecosystem mature and become integrated, efficiency improvements, accelerated discoveries and increased productivity can result. Here in this paper, we review emergent components of this polymer informatics ecosystem and discuss imminent challenges and opportunities.

36 MATERIALS SCIENCE↗

The effect of fabrication on corrosion in aluminum 2195: Environmental and microstructural considerations

Aluminum alloys containing lithium are particularly attractive to the aerospace structural designer. Lithium's density is only 0.53 g/cc, thus an addition of one weight percent lithium not only increases yield strength, but decreases the density by almost three percent while increasing the modulus by over six percent. The fact that lithium improves these physical properties simultaneously has led to intense study and development of the alloy system. Heretofore, problems in large scale alloy production have retarded commercial development. During the last fifteen years, advances in production technology have rekindled interest in Al-Li alloys, and aluminum suppliers have developed many candidate aerospace materials. However, if these alloys are to be employed successfully, a more complete understanding of their nonequilibrium metallurgy is required. Peel and Starke have each pointed out that an understanding of the weldability of these alloys is a critical step in their implementation. This study addresses the critical lack of information on the environmental compatibility of welded Al 2195 components. Corrosion data for these systems is incomplete, particularly for welded materials exposed to sea water or sea water condensate.

Walsh, Daniel W.↗

Validation of Computational Fluid Dynamics Simulations for Biological Performance Assessment in Hydropower units (Final Report)

The biological performance assessment (BioPA) toolset developed by Pacific Northwest National Laboratory (PNNL) estimates the relative biological performance of fish passage at a hydroelectric power turbine unit. The tool is based on the use of computational fluid dynamics (CFD) and fish biological response relationships. The recent release, BioPA-v3, is based on directly computed trajectory and collision of material Lagrangian particles using CFD simulation codes rather than the prior version that relies on Tecplot to compute streamtrace trajectories. Before modifying the toolset, a series of validation tests were performed at the various steps of modification in the toolset. Validation is a critical step of any numerical investigation that reflects the accuracy and reliability of the predicted results. It raises the confidence level of the user to use the modified version of the BioPA toolset. Several test cases were simulated and compared, where available, to observed data. The trajectory and collision of the small spherical and cylindrical particles in a water flume were compared to in-house experiments. The CFD predicted collision rate and flow field compared well with experimental observation for vane array and large cylinder as target bodies. Next, the CFD-predicted flow field and hydraulic performance of a laboratory-scale model of a Francis turbine was also successfully validated. Note that the trajectory of the particles is significantly affected by the flow field in such extreme conditions. In addition to the particle trajectories and flow field, the collision detection method employed in the CFD simulations was also successfully validated. The CFD predicted impact velocity, collision time, velocity, and trajectory of a sphere excellently matched with analytical value for a bouncing ball in the elastic collision. A similar approach was also tested and successfully validated for a collision of sphere with a 45° inclined plane. After successfully validating different cases, the BioPA toolset was modified to use direct output of the CFD prediction and the new version can be used in evaluating biological performance at hydroelectric turbines.

13 HYDRO ENERGY↗

Stereo Particle Image Velocimetry Measurements of Transition Downstream of a Forward-Facing Step in a Swept-Wing Boundary Layer

Stereo particle image velocimetry measurements were performed downstream of a forward-facing step in a stationary-crossflow dominated flow. Three different step heights were studied with the same leading-edge roughness configuration to determine the effect of the step on the evolution of the stationary-crossflow. Above the critical step height, which is approximately 68% of the boundary-layer thickness at the step, the step caused a significant increase in the growth of the stationary crossflow. For the largest step height studied (68%), premature transition occurred shortly downstream of the step. The stationary crossflow amplitude only reached approximately 7% of U(sub e) in this case, which suggests that transition does not occur via the high-frequency secondary instabilities typically associated with stationary crossflow transition. The next largest step of 60% delta still caused a significant impact on the growth of the stationary crossflow downstream of the step, but the amplitude eventually returned to that of the baseline case, and the transition front remained the same. The smallest step height (56%) only caused a small increase in the stationary crossflow amplitude and no change in the transition front. A final case was studied in which the roughness on the leading edge of the model was enhanced for the lowest step height case to determine the impact of the stationary crossflow amplitude on transition. The stationary crossflow amplitude was increased by approximately four times, which resulted in premature transition for this step height. However, some notable differences were observed in the behavior of the stationary crossflow mode, which indicate that the interaction mechanism which results in the increased growth of the stationary crossflow downstream of the step may be different in this case compared to the larger step heights.

Eppink, Jenna L.↗

A Geophysicist's Guide to the Fairfield Nodes

This report details how to successfully use the Fairfield Nodal ZLand seismic instruments to collect data, including preparation steps prior to deploying the instruments, how to record data during a field campaign, and how to retrieve recorded data from the instruments after their deployment. This guide will walk through each step for the novice user, as well as provide a checklist of critical steps for the advanced user to ensure successful, efficient field campaigns and seismic data collection. Currently, use of the seismic nodal instruments is highly limited due to the detailed nature and prior knowledge required to successfully set up, use, and retrieve data from these instruments. With this guide, all interested users will have the knowledge required to perform a seismic deployment and collect data with the Fairfield Nodal instruments.

47 OTHER INSTRUMENTATION↗