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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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Enhancing lithium metal batteries with a nano-silicon nitride-based solid electrolyte interface layer
Artificial nano Si 3 N 4 derived solid electrolyte interphase enables dendrite-free lithium cycling, effectively suppressing dendrite growth and delivering stable, long-term Li metal anode performance.
Corrosion kinetics of pure metals (Fe, Cr, Ni) and alloys (A709, SS316) in thermal and chemical purified molten chloride salt
This paper applied electrochemical methods to explore the corrosion mechanisms of metals and steels in purified molten chloride salt, especially under conditions dominated by cathodic diffusion limitations.
Identifying structure-function relationships to modulate crossover in nonaqueous redox flow batteries
QSPR analyses can be used to identify useful descriptors leading to statistical models for membrane crossover. This data-driven approach can be used to evaluate ROMs for asymmetric non-aqueous redox flow batteries.
Water-enhanced CO 2 capture with molecular salt sodium guanidinate
Solid-state amine absorbent materials, including those containing guanidine derivatives, have received tremendous attention as the world combats the challenges of climate change.
Advancements in 2D MXene-based supercapacitor electrodes: synthesis, mechanisms, electronic structure engineering, flexible wearable energy storage for real-world applications, and future prospects
Supercapacitors are widely recognized as a favorable option for energy storage due to their higher power density compared to batteries, despite their lower energy density.
The high-valent vanadium chemistry of isoindoline chelates
Isoindoline-based chelates, in particular bis(arylimino)isoindolines, have shown extensive metal binding chemistry. Although this chemistry has been explored for the middle and late transition metal ions, little work has been carried out on early transition metal complexes. In this article, we present the first examples of vanadium coordinated using four bis(arylimino)isoindolines, in which the aryl groups are pyrazole, indazole, benzimidazole, and pyridine (ligands 1–4 , respectively). We isolated five complexes using vanadyl sulfate or vanadyl acetylacetonate as the vanadium source. In all cases, the ligands bound in a meridional mode, and for four of the complexes, the vanadium ion was observed in the V(v) oxidation state. Three of the ligands ( 1–3 ) formed VO 2 complexes with vanadyl sulfate and vanadyl acetylacetonate, but the bis(pyridylimino)isoindoline (ligand 4 ) formed a V(v) oxosulfonato complex with the former starting material and a vanadyl V(iv) acetylacetonate with the latter starting material. All metal compounds were structurally elucidated by X-ray crystallographic methods, and we probed their electronic structures using DFT methods.
Broadening solid ionic conductor selection for sustainable and earth-abundant solid-state lithium metal batteries
We propose a universal solid electrolyte design that broadens the selection of ceramic LICs for solid-state lithium metal batteries, without requirements of electronic insulation or (electro)chemical stability.
PAL 2.0: a physics-driven bayesian optimization framework for material discovery
PAL 2.0 provides an efficient discovery tool for advanced functional materials, ameliorating a major bottleneck to enabling advances in next-generation energy, health, and sustainability technologies.
HANNA: hard-constraint neural network for consistent activity coefficient prediction
We introduce HANNA, the first hybrid neural network model that strictly complies with all thermodynamic consistency criteria for predicting activity coefficients and outperforms current benchmark methods in terms of accuracy and applicability.
Synthesis, chloride-ion diffusion mechanisms, and anisotropic sintering of 2D layered erbium oxychloride nanoplatelets
Ligand-passivated ErOCl nanocrystals have been synthesized using a non-hydrolytic sol–gel method. Anisotropic sintering of ErOCl nanocrystals enhances 2D chloride-ion diffusion along theabplane, yielding a promising candidate for halide batteries.
Harnessing the power of thermoplastic elastomer-derived ordered mesoporous carbons through functionalization
This work demonstrates a series of functionalization methods to enhance the utility of thermoplastic-elastomer derived ordered mesoporous carbons, including chemical activation, heteroatom doping, and the introduction of nanoparticles.
Synergistic design of g-C 3 N 4 -supported CNTs: experimental and DFT insights for enhanced electrochemical performance in flexible Li–S batteries
A schematic for the preparation of a g-C 3 N 4 -CNT/S composite cathode for lithium–sulfur batteries.
Reactive silver inks: a path to solar cells with 82% less silver
ITRPV silver consumption of standard low-temperature and high-temperature paste as compared to reactive silver ink. As little as 16.4 mg of silver is consumed when a busbarless cell is metallized with reactive silver ink.
Machine learning-assisted 3D printing of thermoelectric materials of ultrahigh performances at room temperature
Optimizedviamachine learning, extrusion printed thermoelectric materials (BiSbTe) achieve an ultrahighzTof 1.3 at room temperature.