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Using ab initio MD simulations and energy calculations, we investigate the diffusivity, stability, and electrochemical window of the recently discovered superionic conductor Li10GeP2S12. We provide an explanation for the observed wide electrochemical stability of Li10GeP2S12 and demonstrate that Li10GeP2S12 is a 3D, rather than 1D. ion conductor.
We construct a data set of metal-organic framework (MOF) linkers and employ a fine-tuned GPT assistant to propose MOF linker designs by mutating and modifying the existing linker structures. This strategy allows the GPT model to learn the intricate language of chemistry in molecular representations, thereby achieving an enhanced accuracy in generating linker structures compared with its base models. Aiming to highlight the significance of linker design strategies in advancing the discovery of water-harvesting MOFs, we conducted a systematic MOF variant expansion upon state-of-the-art MOF-303 utilizing a multidimensional approach that integrates linker extension with multivariate tuning strategies. We synthesized a series of isoreticular aluminum MOFs, termed Long-Arm MOFs (LAMOF-1 to LAMOF-10), featuring linkers that bear various combinations of heteroatoms in their five-membered ring moiety, replacing pyrazole with either thiophene, furan, or thiazole rings or a combination of two. Beyond their consistent and robust architecture, as demonstrated by permanent porosity and thermal stability, the LAMOF series offers a generalizable synthesis strategy. Importantly, these 10 LAMOFs establish new benchmarks for water uptake (up to 0.64 g g<sup>-1</sup>) and operational humidity ranges (between 13 and 53%), thereby expanding the diversity of water-harvesting MOFs.
We study the bifurcations of attractors of a one-dimensional 2-segment piecewise-linear map. We prove that the parameter regions of existence of stable point cycles γ are separated by regions of existence of stable interval cycles Γ containing chaotic everywhere dense trajectories. Moreover, we show that the period-doubling phenomenon for cycles of chaotic intervals is characterized by two universal constants δ and α, whose values are calculated from explicit formulas.
It is shown that β, the initial postmaximum rate of SN brightness decline (in the B band) defined by Pskovskii, may have a smaller dispersion among SNe Ia in elliptical galaxies than in all other types of galaxies. Contamination of the sample by SNe Ib is unlikely to be the primary cause of this difference. Although the number of objects is very small, it is also possible that the velocity of SN Ia ejecta in elliptical galaxies is lower than in spiral galaxies. If correct, these observations provide the first direct evidence for physical differences among SNe Ia in different environments; reddening variations due to gas and dust are unlikely to produce most of the observed dispersion in β among spirals. One obvious possibility is that the SNe Ia in spiral galaxies come from intermediate-mass stars and that differences in the metallicities, accretion rates, or other properties account for the observations. A more extreme, improbable explanation is that not all SNe Ia in spiral galaxies result from carbon deflagrations of carbon-oxygen white dwarfs.
This paper introduces an analytic method to determine the sensitivity to random parameter variations of analog VLSI neural network architectures for linear image filtering. The authors compare the robustness of several different circuit architectures for low pass filtering. This method can also determine which components within a particular architecture should specified the most precisely. >
An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
The synthesis of dendritic polyether macromolecules based on a 3, 5-dihydroxybenzyl alcohol building block and having carboxylate groups as chain-ends is described. These novel macromolecules behave as unimolecular micelles and their ability to solvate hydrophobic molecules has been investigated by UV–VIS spectroscopy. A dramatic increase in the saturation concentration of various polycyclic aromatic compounds in water was observed which was of a magnitude similar to that observed for micelles derived from sodium dodecyl sulfate. A relationship between the solubilizing power of the dendrimer and the electron density of the polycyclic aromatic was found. A linear relationship between the solubilizing ability and the concentration of the dendrimer, even at concentrations as low as 5 × 10–7 mol dm–3, indicates that these materials do not have a critical micelle concentration. Increases in the ionic strength of an aqueous solution of the dendrimer caused an increase in the saturation concentration of the hydrophobic molecules. A recyclable solubilization and extraction system is discussed. The synthesis of a globular dendritic macromolecular amphiphile designed to reside at the interface of an organic solvent and water is also described. This 'hybrid' dendritic amphiphile consisting of two distinct sectors, one hydrophilic and the other hydrophobic is prepared by stepwise alkylation of a core molecule, 4,4′-dihydroxybiphenyl with the two dissimilar dendritic fragments.
ADVERTISEMENT RETURN TO ISSUEPREVArticleNEXTSynthesis and characterization of hyperbranched polyurethanes prepared from blocked isocyanate monomers by step-growth polymerizationRalph Spindler and Jean M. J. FrechetCite this: Macromolecules 1993, 26, 18, 4809–4813Publication Date (Print):August 1, 1993Publication History Published online1 May 2002Published inissue 1 August 1993https://pubs.acs.org/doi/10.1021/ma00070a013https://doi.org/10.1021/ma00070a013research-articleACS PublicationsRequest reuse permissionsArticle Views2293Altmetric-Citations162LEARN ABOUT THESE METRICSArticle Views are the COUNTER-compliant sum of full text article downloads since November 2008 (both PDF and HTML) across all institutions and individuals. These metrics are regularly updated to reflect usage leading up to the last few days.Citations are the number of other articles citing this article, calculated by Crossref and updated daily. Find more information about Crossref citation counts.The Altmetric Attention Score is a quantitative measure of the attention that a research article has received online. Clicking on the donut icon will load a page at altmetric.com with additional details about the score and the social media presence for the given article. Find more information on the Altmetric Attention Score and how the score is calculated. Share Add toView InAdd Full Text with ReferenceAdd Description ExportRISCitationCitation and abstractCitation and referencesMore Options Share onFacebookTwitterWechatLinked InRedditEmail Other access optionsGet e-Alertsclose Get e-Alerts