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At least 307 records · Page 17

All sources NASA NTRS DOE OSTI

DOE OSTI2024

In-situ qualification and physics-based process design for aerosol jet printing via spatially correlated light scattering measurements

Aerosol jet printing is a contactless, digital, and additive technique broadly used for manufacturing flexible, hybrid, and conformal electronics. However, batch-to-batch variability has hindered widespread industry adoption and scaling to production volumes. Recently, light scattering measurements have emerged as a tool to measure aerosol volume fraction – a key parameter determining deposition rate – and have proven an effective feedback source for closed loop control on timescales ranging from minutes to hours. Here, the efficacy of light scattering measurements as a tool for in-situ qualification over shorter time durations is explored. To be the linear relationship between light scattering measurements and deposition rate was validated at 500 ms time intervals, allowing deposition rate to be mapped to positional coordinates and providing a new data stream to drive quality control assessments. Because light scattering measurements are indicative of a physical process parameter, they were substituted into equations for resistance and sheet resistance, resulting in predictions nominally within 10% of measured values for sets of printed devices. Finally, to highlight a more active utility, light scattering measurements were employed in a print repair framework, successfully repairing prints with randomly induced defects to within 5% of the measured resistance of a control set.

36 MATERIALS SCIENCE↗

DOE OSTI2020

Reaching 90% Photoluminescence Quantum Yield in One-Dimensional Metal Halide C 4 N 2 H 14 PbBr 4 by Pressure-Suppressed Nonradiative Loss

Low-dimensional perovskite-related metal halides have emerged as a new class of light-emitting materials with tunable broadband emission from self-trapped excitons (STEs). Although various types of low-dimensional structures have been developed, fundamental understating of the structure–property relationships for this class of materials is still very limited, and further improvement of their optical properties remains greatly important. Here, we report a significant pressure-induced photoluminescence (PL) enhancement in a one-dimensional hybrid metal halide C 4 N 2 H 14 PbBr 4 , and the underlying mechanisms are investigated using in situ experimental characterization and first-principles calculations. Under a gigapascal pressure scale, the PL quantum yields (PLQYs) were quantitatively determined to show a dramatic increase from the initial value of 20% at ambient conditions to over 90% at 2.8 GPa. With in situ characterization of photophysical properties and theoretical analysis, we found that the PLQY enhancement was mainly attributed to the greatly suppressed nonradiative decay. Pressure can effectively tune the energy level of self-trapped states and increase the exciton binding energy, which leads to a larger Stokes shift. The resulting highly localized excitons with stronger binding reduce the probability for carrier scattering, to result in the significantly suppressed nonradiative decay. Overall, our findings clearly show that the characteristics of STEs in low-dimensional metal halides can be well-tuned by external pressure, and enhanced optical properties can be achieved.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

NASA NTRS2012

Hybrid Collaborative Learning for Classification and Clustering in Sensor Networks

Traditionally, nodes in a sensor network simply collect data and then pass it on to a centralized node that archives, distributes, and possibly analyzes the data. However, analysis at the individual nodes could enable faster detection of anomalies or other interesting events as well as faster responses, such as sending out alerts or increasing the data collection rate. There is an additional opportunity for increased performance if learners at individual nodes can communicate with their neighbors. In previous work, methods were developed by which classification algorithms deployed at sensor nodes can communicate information about event labels to each other, building on prior work with co-training, self-training, and active learning. The idea of collaborative learning was extended to function for clustering algorithms as well, similar to ideas from penta-training and consensus clustering. However, collaboration between these learner types had not been explored. A new protocol was developed by which classifiers and clusterers can share key information about their observations and conclusions as they learn. This is an active collaboration in which learners of either type can query their neighbors for information that they then use to re-train or re-learn the concept they are studying. The protocol also supports broadcasts from the classifiers and clusterers to the rest of the network to announce new discoveries. Classifiers observe an event and assign it a label (type). Clusterers instead group observations into clusters without assigning them a label, and they collaborate in terms of pairwise constraints between two events [same-cluster (mustlink) or different-cluster (cannot-link)]. Fundamentally, these two learner types speak different languages. To bridge this gap, the new communication protocol provides four types of exchanges: hybrid queries for information, hybrid "broadcasts" of learned information, each specified for classifiers-to-clusterers, and clusterers-to-classifiers. The new capability has the potential to greatly expand the in situ analysis abilities of sensor networks. Classifiers seeking to categorize incoming data into different types of events can operate in tandem with clusterers that are sensitive to the occurrence of new kinds of events not known to the classifiers. In contrast to current approaches that treat these operations as independent components, a hybrid collaborative learning system can enable them to learn from each other.

Wagstaff, Kiri L.↗

DOE OSTI2023

On the melt pool dynamic of voxel-controlled metal matrix composites via hybrid additive manufacturing: Laser powder bed fusion and ink-jetting

In this study, the effect of the addition of reinforcement nanoparticles to the 316L matrix by adopting ex-situ and in-situ method (drop on demand jetting) to produce 316L/Al 2 O 3 nanocomposite was investigated. In the ex-situ method, the Al 2 O 3 nanoparticles (NPs) were lightly mixed with 316L powder and processed by laser powder bed fusion. In the in-situ method, an ethanol-based ink containing Al 13 nanoclusters (NCs) was added to 316L powder and then processed by laser. Both ex-situ and in-situ method produced nanocomposites with Al-Si-Mn-O-enriched precipitations within the 316L matrix. The addition of NPs/NCs to the 316L matrix, altered the geometrical characteristic of the single-track melt pools. At the same laser power, with increasing the amount of Al 2 O 3 NPs and Al 13 NCs the melt pool deepened due to reduced thermal conductivity and prolonged liquid presence. Further, as a result, 316L/1 wt% Al 13 NCs deposited single track showed larger grains in comparison to 316L single track. At a high laser power of 150W, the Marangoni flow and the buoyancy force caused the nanoparticles to agglomerate and float to the top surface of tracks; therefore, the wt% fraction of precipitation was drastically reduced due to the loss of Al. The 316L/Al 2 O 3 NPs and 316L/Al 13 NCs exhibited the microhardness of 285 ± 13 HV and 293 ± 7 HV, respectively, higher than the deposited 316L single track, 265 ± 15 HV. Lastly, a hybrid LPBF+ink-jet printer was adopted to selectively change the composition of different zones by adding Al 13 NCs ink to 316L and producing a voxel-controlled metal matrix composite.

316L↗

DOE OSTI2021

In-situ Photophysical Monitors and Corrective Algorithms for Photovoltaic Film Deposition and Rapid Thermal Processing in Scalable Roll-to-Roll Manufacturing

This project evaluated three photophysics-based approaches for in situ process monitoring of the scalable deposition of perovskite photovoltaic films. Based on stakeholder input and the results of laboratory trials and literature analysis, two techniques, angle resolved elastic light scattering (ARLS) and time-resolved photoluminescence (TRPL) were prototyped and demonstrated with a mixture of simulation, offline and online tests. Also, a hybrid gas flow and humidity control enclosure was constructed and demonstrated to stabilize the ambient conditions around the slot die deposition process and were demonstrated to meet the target humidity control in situ. Due in part to a delayed start and COVID-related lab restrictions and personnel changes, some of the milestones were not met. In spite of these challenges, however, both techniques were prototyped through several iterations and demonstrated significant promise for rapid in line perovskite characterization within the targeted characterization time windows and these techniques are under further development for use in DE-FOA000235:2357-1586. The TRPL system was fully mounted and demonstrated on the scaled slot die roll to roll and sheet coating systems at the Washington Clean Energy Testbeds (WCET). Motivated by significant internal and stakeholder interest, the successful prototyping achieved here, the ongoing need for in-situ characterization for the scale-up of perovskite manufacturing, and the benefits of in situ photophysical characterization for future funded process development research, we are continuing with the principle aims of the project to develop effect in situ photophysical probes for fast analysis of the optoelectronic and structural quality of sheet based and roll to roll process perovskites. TRPLS and ARLS probes proposed in the project are to be completed with external support from the Washington Research Foundation at the WCET. We are currently actively engaged in the acquisition of components and plan to complete and test the probes within three months. It is our intention that these probes will then be used in ongoing perovskite development with our research and commercialization partners including First Solar and other member of the US MAP consortium in future funded development work.

14 SOLAR ENERGY↗

DOE OSTI2025

Plasma-Assisted Surface Nitridation of Proton Intercalatable WO 3 for Efficient Electrocatalytic Ammonia Synthesis

Electrocatalytic nitrogen reduction (eNRR) offers a green pathway for the production of NH 3 from N 2 and H 2 O under ambient conditions. Transition metal oxynitrides (TMO x N y ) are among the most promising catalysts but face challenges in achieving a high yield and faradaic efficiency (FE). This work develops a hybrid WO x N y /WO 3 catalyst with a unique heterogeneous interfacial complexion (HIC) structure. This design enables in situ generation and delivery of highly active hydrogen atoms (H*) in acidic electrolytes, promoting nitrogen hydrogenation and the formation of nitrogen vacancies (Nv) on the WO x N y surface. This significantly enhances the selectivity of eNRR for NH 3 synthesis while suppressing the hydrogen evolution reaction (HER). A simple two-step fabrication process─microwave hydrothermal growth followed by plasma-assisted surface nitridation─was developed to fabricate the designed catalyst electrode, achieving an NH 3 yield of 3.2 × 10 –10 mol·cm –2 ·s –1 with 40.1% FE, outperforming most TMN/TMO x N y electrocatalysts. Multiple control experiments confirm that the eNRR follows an HIC-enhanced Mars–van Krevelen (MvK) mechanism.

Catalysts↗

NASA NTRS2020

Hawai'i Water Resources: Utilizing NASA Earth Observations to Assess Ocean Conditions Leading to the Spread of the Nuisance Red Algae (Chondria tumulosa) in Papahānaumokuākea Marine National Monument, Hawai’i

Chondria tumulosa, a newly discovered red alga, was observed in low abundance in 2016 but has since proliferated and is now smothering and decimating vast expanse of coral reefs in Manawai, located in Papahānaumokuākea Marine National Monument (PMNM). If the spread persists, the outbreak of this cryptogenic species could potentially cause region-wide ecosystem degradation. In coordination with the U.S. Fish and Wildlife Service, Marine National Monuments of the Pacific and the National Oceanographic and Atmospheric Administration (NOAA) Office of National Marine Sanctuaries’ Papahānaumokuākea Marine National Monument, this project created a tool to analyze oceanographic conditions (sea surface temperature (SST), chlorophyll-a, water velocity, salinity, turbidity) across the Monument that could potentially be driving the algal spread. The Google Earth Engine tool enabled the partners to visualize oceanographic conditions and gather time-series graphs utilizing Aqua and Terra Moderate Resolution Imaging Spectroradiometer (MODIS), Suomi National Polar-orbiting Partnership (NPP) Visible Infrared Imaging Radiometer Suite (VIIRS), Sentinel-3 Ocean and Land Colour Instrument (OLCI), Hybrid Coordinate Ocean Model (HYCOM) and NOAA's Climate Data Record in a user-friendly interface. The team used in situ SST data from subsurface temperature recorders provided by the partners to validate the tool's accuracy. Preliminary statistical analysis of MODIS data found warming trends in SST in Manawai as well as increased chlorophyll-a levels during the summer months in contrast to the control (non-infected) Lalo atoll. The tool did not aim to classify algal presence due to limited availability of higher resolution satellite imagery but instead enabled PMNM managers to monitor conditions that may be conducive to algal growth around the monument to make informed decisions and mitigation practices.

DEVELOP Project Summary↗

DOE OSTI2026

The Effect of Large-scale Magnetic Fluctuations on Energetic Particle Profiles across Interplanetary Shocks

In situ observations of energetic particles associated with interplanetary (IP) shocks, known as energetic storm particle (ESP) events, often show time-intensity profiles quite different from predictions of classical diffusive shock acceleration theory. We use numerical simulations, including test-particle simulations and hybrid simulations (with fluid electrons and kinetic protons) for shocks propagating into a turbulent magnetic field to study the ESP intensity-time profiles across a strong IP shock. We find that several types of energetic particle intensity profiles similar to in situ observations can be produced in our simulations. The peak of energetic particle count is often near, but can be shifted from, the locations of the shock front, with the peak usually being observed downstream of the shock. These findings may help understand particle acceleration at both traveling IP shocks and shocks in other heliospheric and astrophysical environments.

Lo, Ming-Yuan [New Mexico Consortium (NMC), Los Al↗

DOE OSTI2021

Multi-Messenger In-situ Tolerance Optimization of Mixed Perovskite Photovoltaics. Final Report

The main objectives for this project were to formulate, validate and disseminate a new procedure based on Environmental X-ray Photoelectron Spectroscopy (EXPS) for the accelerated degradation testing of metal hybrid perovskite (MHP) PV materials. With this capability, we can aid US efforts to improve MHP tolerance for illumination in damp heat conditions. This capability will benefit the public by supporting new industry efforts to create stable MHP formulations.

14 SOLAR ENERGY↗

DOE OSTI2022

Hybrid Analysis of Fusion Data for Online Understanding of Complex Science on Extreme Scale Computers

The current practice for fusion scientists running first principle simulations on high performance computing plat-forms is to either run their simulations and output their data for post-hoc analysis, or to place in situ analytics into their code. In this paper we examine a complex workflow using XGC fusions simulation run on the Oak Ridge Leadership Computing Facility's supercomputer Summit, which also involve three anal-yses as part of the results necessary for scientific discovery. We discuss the challenges faced when implementing these algorithms and present an original hybrid staging technique to help enable the physicists to make discoveries during the execution of the simulation. By creating this infrastructure, we can examine complicated physics results, which may not have been possible without the infrastructure. For example, our work enables the online visualization of turbulent homoclinic tangle around the magnetic X-point, breaking the last confinement surface. This visualization could help fusion scientists to better understand and improve the turbulence spread of plasma exhaust heat, which is crucial toward realizing plasmas beyond the currently accessible physics regimes of present-day tokamak reactors. The physics of turbulent homoclinic tangle will be reported in a future physics publication, by utilizing the original online analysis/visualization framework presented in this paper.

Suchyta, Eric↗

DOE OSTI2025

Synergistic effects of Pd single atoms and nanoclusters boosting SnO 2 gas sensing performance

Tin(IV) oxide-supported Pd is a promising heterogenous catalyst for CO oxidation relevant for environmental cleanup reactions. In this study, an atomically dispersed Pd catalyst on SnO 2 (ADC Pd/SnO 2 ) hybrid material is successfully synthesized via a straightforward wet chemistry method and is found to exhibit superior performance toward CO sensing. Ex situ EXAFS analysis confirms the formation of single Pd atoms and small Pd nanoclusters stabilized on the SnO 2 (110) surface. Further, the material exhibits high efficiency in generating adsorbed O 2 - as well as high activity in catalyzing CO oxidation at low temperatures, resulting in exceptional sensitivity and selectivity toward CO in comparison to pure SnO 2 and Pd nanoparticles loaded on SnO 2 respectively. In situ FTIR measurements unravel CO adsorption kinetics on ADC Pd/SnO 2 under reaction conditions, and a possible sensing mechanism is put forth in which CO is transformed into CO 2 by reaction with active oxygen species; and concurrently, carbon-related species (bicarbonates and carbonates) are formed and decomposed into CO 2 .

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

NASA NTRS1993

Three-dimensional simulations of the solar wind interaction with Mars

Three-dimensional hybrid particle simulations of the dayside portion of the Mars/solar wind interaction have been performed. These simulations are compared with the in situ measurements taken during the elliptical orbits of Phobos 2. The comparisons show considerable agreement between the magnetic field data and the simulations results. The results of the simulations bring into question the type of structures created in the subsolar region of Mars. It appears that the large larmor radius of the solar wind ions prevents the formation of a traditional collisionless shock in the subsolar region of the interaction.

Brecht, Stephen H.↗

DOE OSTI2023

Understanding In-Situ Structure and Chemistry at Battery Interfaces Through Time-Resolved Cryo-EM

Transmission and scanning transmission electron microscopy are vital tools for characterizing interfacial structure and chemistry at high spatial resolutions but are limited by the fact that many materials are quickly damaged by electron beam irradiation. This is a challenge particularly for materials relevant to energy applications, such as lithium-containing battery materials, organic-inorganic hybrids, and liquid electrolytes. Cryogenic electron microscopy (cryo-EM) offers a partial solution to this issue by stabilizing beam-sensitive solid-solid or solid-liquid interfaces for characterization, but typical cryo-EM sample preparations are ex situ and thus cannot capture interfaces in their electrified state of interest to applications. Here, we present a method to prepare cryo-EM samples of electrified battery interfaces in situ to preserve the time-resolved structures and chemistry that arise under applied current or bias.

batteries↗

DOE OSTI2026

ALD with Alternative Coreactants: Which Work, Which Do Not, and Why

In this paper, we present a combined experimental and theoretical study that systematically evaluates a series of alcohols (i.e., primary, secondary, and tertiary) as coreactants for trimethylaluminum (TMA)-based atomic layer deposition (ALD) of Al 2 O 3 . We employed in situ quartz crystal microbalance techniques and ex situ X-ray photoelectron spectroscopy to probe growth across a range of temperatures from T = 120 to 285 °C. Dispersion-inclusive hybrid density functional theory was employed to identify potential reaction pathways and compute corresponding Gibbs free-energy barriers and rate coefficients. Experimentally on an Al 2 O 3 surface, sustained thin-film growth, where the rate is constant over many cycles, was only observed with tertiary alcohols (tert-butanol and 2-methyl-2-butanol) at elevated temperatures (e.g., T = 285 °C); for tert-butanol specifically, sustained growth also occurred at T = 240 °C, with no sustained growth at or below T = 210 °C. Growth using primary and secondary alcohols decayed to a negligible value after only 2–3 cycles on an Al 2 O 3 surface at all tested temperatures. Intentional trace additions of H 2 O to anhydrous alcohols restored sustained growth but at reduced deposition rates relative to pure H 2 O. Theoretical analysis supports a bimolecular alkoxy β-H elimination mechanism as the primary reaction pathway: initiated by the formation of a bound alkoxy species, the subsequent β-H elimination step is rate-determining, with a barrier that systematically decreases as the degree of the alcohol coreactant is increased from primary to secondary to tertiary. Computed rate coefficients (k) also indicate a strong temperature dependence (with k increasing by ∼4–5 orders of magnitude from T = 120 to 285 °C) and are consistent with the experimental observation that only tertiary alcohols lead to steady thin-film growth at elevated temperatures. This integrated approach establishes why only certain alcohols can sustain Al 2 O 3 ALD and delivers a predictive framework for identifying effective alcohol coreactants.

36 MATERIALS SCIENCE↗

NASA NTRS2012

Pickup Protons: Comparisons using the Three-Dimensional MHD HHMS-PI model and Ulysses SWICS Measurements

We report the first comparisons of pickup proton simulation results with in situ measurements of pickup protons obtained by the SWICS instrument on Ulysses. Simulations were run using the three dimensional (3D) time-dependent Hybrid Heliospheric Modeling System with Pickup Protons (HHMS-PI). HHMS-PI is an MHD solar wind model, expanded to include the basic physics of pickup protons from neutral hydrogen that drifts into the heliosphere from the local interstellar medium. We use the same model and input data developed by Detman et al. (2011) to now investigate the pickup protons. The simulated interval of 82 days in 2003 2004, includes both quiet solar wind (SW) and also the October November 2003 solar events (the Halloween 2003 solar storms). The HHMS-PI pickup proton simulations generally agree with the SWICS measurements and the HHMS-PI simulated solar wind generally agrees with SWOOPS (also on Ulysses) measurements. Many specific features in the observations are well represented by the model. We simulated twenty specific solar events associated with the Halloween 2003 storm. We give the specific values of the solar input parameters for the HHMS-PI simulations that provide the best combined agreement in the times of arrival of the solar-generated shocks at both ACE and Ulysses. We show graphical comparisons of simulated and observed parameters, and we give quantitative measures of the agreement of simulated with observed parameters. We suggest that some of the variations in the pickup proton density during the Halloween 2003 solar events may be attributed to depletion of the inflowing local interstellar medium (LISM) neutral hydrogen (H) caused by its increased conversion to pickup protons in the immediately preceding shock.

Intriligator, Devrie S.↗

NASA NTRS2024

NASA Marshall Space Flight Center In-Space Cryogenic Propulsion Capabilities and Applications to Human Exploration

The current focus on lunar exploration and future human missions to Mars is driving in-space propulsion system requirements toward higher performance cryogenic systems with long-duration storage and operational capabilities. Not only do these systems offer higher performance than storable propellant options, but they also enable the potential for in-situ propellant production. Future Mars transit systems are envisioned to utilize either high-thrust nuclear thermal propulsion (with liquid hydrogen propellant), or hybrid systems with both cryogenic chemical systems (likely LOX/CH4) for high acceleration maneuvers and nuclear electric systems for long duration high Isp maneuvers. Exploration architectures based on either of these options require the use of high-performance cryogenic propellants with long-duration storage capabilities for both in-space transportation as well as planetary descent and ascent functions. Current efforts focusing on lunar exploration also rely on cryogenic propellants (either LOX/LCH4 or LOX/LH2) for lunar transit and descent/ascent transportation functions. In-space cryogenic propulsion systems pose numerous technology challenges with respect to long-duration propellant storage and usage, including advanced insulation, tank stratification and pressure management, cryogenic refrigeration to reduce propellant loss through boil off, low leakage cryogenic valves, low temperature liquid acquisition, and cryogenic propellant transfer. NASA has invested in technology development efforts, demonstrating individual technologies and systems-level operations. NASA Marshal Space Flight Center has also invested in multiple test facilities and modular test rigs that allow ground demonstration of numerous integrated technologies and systems concepts of operations. Additional investments have been made to mature analytical capabilities and design tools. These capabilities, both test/demonstration & engineering design/analysis, are available to support internal efforts and industrial partners in the development of exploration and science mission systems. With this increased interest, it is critical to understand the current state of in-space cryogenic propulsion technology, determine risks to its successful application to human exploration, and prepare the engineering, test, and evaluation capabilities to support the ambitious plans for future systems. This paper provides a survey of recent developments in in-space cryogenic propulsion and cryogenic propellant management technologies, as well as facilities and engineering/analytical capabilities ready to support current and future exploration efforts.

Cryogenic propulsion, cryogenic fluid management, ↗

NASA NTRS2024

NASA Marshall Space Flight Center In-Space Cryogenic Propulsion Capabilities and Applications to Human Exploration

The current focus on lunar exploration and future human missions to Mars is driving in-space propulsion system requirements toward higher performance cryogenic systems with long-duration storage and operational capabilities. Not only do these systems offer higher performance than storable propellant options, but they also enable the potential for in-situ propellant production. Future Mars transit systems are envisioned to utilize either high-thrust nuclear thermal propulsion (with liquid hydrogen propellant), or hybrid systems with both cryogenic chemical systems (likely LOX/CH 4 ) for high acceleration manoeuvres and nuclear electric systems for long duration high Isp manoeuvres. Exploration architectures based on either of these options require the use of high-performance cryogenic propellants with long-duration storage capabilities for both in-space transportation as well as planetary descent and ascent functions. Current efforts focusing on lunar exploration also rely on cryogenic propellants (either LOX/LCH 4 or LOX/LH 2 ) for lunar transit and descent/ascent transportation functions. In-space cryogenic propulsion systems pose numerous technology challenges with respect to long-duration propellant storage and usage, including advanced insulation, tank stratification and pressure management, cryogenic refrigeration to reduce propellant loss through boil off, low leakage cryogenic valves, low temperature liquid acquisition, and cryogenic propellant transfer. NASA has invested in technology development efforts, demonstrating individual technologies and systems-level operations. NASA Marshal Space Flight Center has also invested in multiple test facilities and modular test rigs that allow ground demonstration of numerous integrated technologies and systems concepts of operations. Additional investments have been made to mature analytical capabilities and design tools. These capabilities (both test/demonstration & engineering design/analysis) are available to support both internal efforts and industrial partners in the development of exploration and science mission systems. With this increased interest, it is critical to understand the current state of in-space cryogenic propulsion technology, determine risks to its successful application to human exploration, and prepare the engineering, test, and evaluation capabilities to support the ambitious plans for future systems. This paper provides a survey of recent developments in in-space cryogenic propulsion and cryogenic propellant management technologies, as well as facilities and engineering/analytical capabilities ready to support current and future exploration efforts.

Cryogenic propulsion↗

NASA NTRS2024

NASA Marshall Space Flight Center In-Space Cryogenic Propulsion Capabilities and Applications to Human Exploration

Cryogenic propulsion, cryogenic fluid management, ↗