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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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This is a guidance document on how to use the compliance reporting tool under the US DOE's Energy Policy Act (EPAct).
This is a guidance document on EPAct Section 707 emergency repair and restoration vehicle exclusions under the US DOE's Energy Policy Act (EPAct).
This is a guidance document on submitting the standard compliance annual report under the US DOE's Energy Policy Act (EPAct).
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The dependence of the product of the first hyperpolarizability, beta, and the ground-state dipole moment, mu, for a series of donor-acceptor polyenes with a large range of ground-state polarization, was measured in a variety of solvents by electric field induced second harmonic generation. The observed behavior of mu times beta as a function of ground-state polarization agrees well with theoretical predictions. In particular, as a function of increasing polarization, mu times beta was found to first increase, peak in a positive sense, decrease, pass through zero, become large and negative, and eventually peak in a negative sense.
The end of regularly scheduled Microgravity Science Payload (MSP), shuttle mission(s), the severely limited ability to accommodate the existing low temperature flight hardware on other carriers, and the anticipated delays in the development schedule for the International Space Station (ISS) in combination have left low temperature microgravity investigations with few (if any) flight opportunities until several years into the next millennium.
This research presents the result of numerically simulating 7-element swirl-venturi Lean Direct Injector (SV-LDI) lean blowout (LBO) experiments conducted at NASA Glenn Research Center in May of 2019. After simulating a cold flow case to confirm the pressure drop agrees well with the experiment, additional cases with two different fuels (an average jet fuel and a Gevo alcohol-to-jet fuel) from the National Jet Fuels Combustion Program (NJFCP) were computed to numerically determine the LBO condition. The procedure to approach the LBO follows the method used in the experiment where the air mass flow rate is gradually increased while the fuel supply is maintained. Transient history of global heat release rate as a function of air flow rate is presented, as well as temperature contours at different conditions to give a visual representation of the flame state. The Open National Combustion Code (OpenNCC) used in this research adopted reduced HyChem (Hybrid Chemistry) models along with k-LES turbulence model and a Lagrangian spray model that takes into account droplet internal temperature distribution affected by the shear force on the droplet surface. The transport equations and chemical reaction terms are integrated together to enhance conservation of chemical species that are especially important in the near LBO conditions. After showing the computed range of LBO agrees well with the experimental measurements, time averaged solutions of both fuels at their initial condition and at their limiting condition just before LBO are compared in detail to facilitate the understanding of LBO mechanism.
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Document describes the two processes through which the U.S. Department of Energy will begin evaluating waiver requests for fiscal year (FY) 2021 (beginning with the FY 2020 data call).
Abstract Evaluating the 2014 El Niño forecast as a “bust” may be tapping into a bigger issue, namely that forecast “overconfidence” from single‐model ensembles could affect the retrospective assessment of El Niño–Southern Oscillation (ENSO) predictions. The present study proposes a new approach to quantifying an “expected” spread and uncertainty from noise‐driven processes and supplementing these measures with actual ENSO forecasts. Expanding on a previously developed coupled model framework that isolates noise‐driven ENSO‐like errors, an experimental design is implemented to generate an expected December Niño‐3.4 spread from March initial condition sea surface temperature errors that have similar structure to the 2014 and 2015 observed. Results reveal that the 2014 ENSO forecast falls within the expected uncertainty generated by ENSO‐independent, forecast‐independent, noise‐driven errors.
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Over the past years, thermoelectric Mg 3 Sb 2 alloys particularly in n-type conduction, have attracted increasing attentions for thermoelectric applications, due to the multivalley conduction band, abundance of constituents, and less toxicity. However, the high vapor pressure, causticity of Mg, and the high melting point of Mg 3 Sb 2 tend to cause the inclusion in the materials of boundary phases and defects that affect the transport properties. In this work, a utilization of tantalum-sealing for melting enables n-type Mg 3 Sb 2 alloys to show a substantially higher mobility than ever reported, which can be attributed to the purification of phases and to the coarse grains. Importantly, the inherently high mobility successfully enables the thermoelectric figure of merit in optimal compositions to be highly competitive to that of commercially available n-type Bi 2 Te 3 alloys and to be higher than that of other known n-type thermoelectrics at 300-500 K. This work reveals Mg 3 Sb 2 alloys as a top candidate for near-room-temperature thermoelectric applications.
Using a novel statistical approach that efficiently explores the space of possible defect configurations, our present study investigates the chemomechanical coupling between interfacial structural defects and phase boundary alignments within phase-separating electrode particles. Applied to the battery cathode material Li X FePO 4 as an example, the theoretical analysis reveals that small, defect-induced deviations from an ideal interface can lead to dramatic shifts in the orientations of phase boundaries between Li-rich and Li-lean phases, stabilizing otherwise unfavorable orientations. Significantly, this stabilization arises predominantly from configurational entropic factors associated with the presence of the interfacial defects rather than from absolute energetic considerations. The specific entropic factors pertain to the diversity of defect configurations and their contributions to rotational/orientational rigidity of phase boundaries. Comparison of the predictions with experimental observations indicates that the additional entropy contributions indeed play a dominant role under actual cycling conditions, leading to the conclusion that interfacial defects must be considered when analyzing the stability and evolution kinetics of the internal phase microstructure of strongly phase-separating systems. Possible implications for tuning the kinetics of (de)lithiation based on selective defect incorporation are discussed. Ultimately, this understanding can be generalized to the chemomechanics of other defective solid phase boundaries.
Cation-disordered rocksalt (DRX) cathodes have recently emerged as a promising class of cobalt-free, high-capacity cathodes for lithium-ion batteries. To facilitate their commercialization, the development of scalable synthesis techniques providing control over composition and morphology is critical. To this end, a sol-gel synthesis route to prepare Mn-rich DRX cathodes with high capacities is presented here. Several compositions with varied Mn content and nominal F doping are successfully prepared using this technique. In-situ X-ray diffraction measurements demonstrate that DRX formation proceeds at moderate temperature (800 °C) through the sol-gel route, which enables intimate mixing among reactive intermediate phases that form at lower temperatures. All synthesized compositions possess cation short-range order, as evidenced by neutron pair distribution function and electron diffraction analysis. These DRX materials demonstrate promising electrochemical performance with reversible capacities up to 275 mAh g. Compared to the baseline oxide (Li 1.2 Mn 0.4 Ti 0.4 O 2 ), the Mn-rich compositions exhibit improved cycling stability, with some showing an increase in capacity upon cycling. Finally, this study demonstrates the feasibility of preparing high-capacity DRX cathodes through a sol-gel based synthesis route, which may be further optimized to provide better control over the product morphology compared to traditional synthesis methods.
Abstract Fluorination has been identified as a key element for enabling the stable cycling of earth‐abundant manganese‐based disordered rock salt (DRX) cathodes. However, fluorination in the DRX bulk remains a challenge for scalable solid‐state synthesis. In this study, a tailored reaction pathway is proposed to synthesize a highly fluorinated DRX. It is demonstrated for the first time that the unconventional precursors, Li 6 MnO 4 , MnF 2 , and TiO 2 , can avoid the formation of Mn‐based intermediates (such as Li 2 (Mn,Ti)O 3, LiMnO 2 , and Mn 3 O 4 ), which, once formed, persist until the synthesis temperature reaches close to or above that required for fluorine volatility. Therefore, this method can form a highly fluorinated DRX with a composition of Li 1.23 Mn 0.40 Ti 0.37 O 2−y F y ( y = 0.29–0.34) at a low temperature (800 °C) relative to that required for conventional DRX solid‐state reactions (≥900 °C). Li 1.23 Mn 0.40 Ti 0.37 O 2−y F y ( y = 0.29–0.34) delivers a specific capacity above 300 mAh g −1 and a specific energy of 980 Wh kg −1 at 30 °C. Detailed characterization reveals that this DRX phase reversibly utilizes Mn 2+/3+ redox in the low‐voltage region and Mn 3+/4+ redox in the middle‐voltage range, whereas reversible oxygen redox is observed at high potentials.
Abstract Lithium–sulfur (Li‐S) batteries have recently received great attention because they promise to provide energy density far beyond current lithium ion batteries. Typically, Li‐S batteries operate by conversion of sulfur to reversibly form different soluble lithium polysulfide intermediates and insoluble lithium sulfides through multistep redox reactions. Herein, we report a functional electrolyte system incorporating dimethyl disulfide as a co‐solvent that enables a new electrochemical reduction pathway for sulfur cathodes. This pathway uses soluble dimethyl polysulfides and lithium organosulfides as intermediates and products, which can boost cell capacity and lead to improved discharge–charge reversibility and cycling performance of sulfur cathodes. This electrolyte system can potentially enable Li‐S batteries to achieve high energy density.