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Using a MixSolDB, a curated solubility dataset for multicomponent solvent systems, a GNN-based framework with semi-supervised distillation from COSMO-RS data improved prediction accuracy and broadened applicability. 

Plastic upcycling, which involves making plastic-derived products with unique or improved properties from discarded plastic materials, is a promising alternative to recycling and disposal to help reduce the overall production of waste. However, recycled and reused materials typically have inferior mechanical, thermal, optical, and barrier properties compared with virgin plastics. Upcycled plastic materials could improve these properties while addressing future waste accumulation. In this study, we use waste poly(ethylene terephthalate) (PET) collected from disposable food packaging to create a repurposed plastic graphene oxide (GO) composite with a goal of upcycling. We developed a one-pot “dynamic depolymerization” to break down PET in the presence of GO and successfully enabled transesterification of the polymer onto GO. Covalent attachment of PET onto GO and tailorable plastic content was confirmed by thermogravimetric analysis, Fourier transform infrared spectroscopy, X-ray photoelectron spectroscopy, and scanning electron microscopy. These covalent composites (PET-GO) were found to be relatively impermeable to water vapor, showing promise for applications in packaging materials. Aqueous degradation experiments on the composite materials demonstrated that, in bulk conditions, PET-GOs remain mechanically robust while in contact with water over appropriate time scales for packaging applications, while beginning to break down in accelerated conditions. The use of depolymerization methods to promote polymer grafting concurrently with polymer deconstruction could provide a more general method for grafting waste polymers onto oxidized carbonaceous substrates with further study. 

Abstract The paper discusses a stabilization of a finite element method for the equations of fluid motion in a time-dependent domain. After experimental convergence analysis, the method is applied to simulate a blood flow in the right ventricle of a post-surgery patient with the transposition of the great arteries disorder. The flow domain is reconstructed from a sequence of 4D CT images. The corresponding segmentation and triangulation algorithms are also addressed in brief. 

Abstract With the increasing use of Li batteries for storage, their safety issues and energy densities are attracting considerable attention. Recently, replacing liquid organic electrolytes with solid‐state electrolytes (SSE) has been hailed as the key to developing safe and high‐energy‐density Li batteries. In particular, Li_1+xAl_xTi_2−x(PO4)₃(LATP) has been identified as a very attractive SSE for Li batteries due to its excellent electrochemical stability, low production costs, and good chemical compatibility. However, interfacial reactions with electrodes and poor thermal stability at high temperatures severely restrict the practical use of LATP in solid‐state batteries (SSB). Herein, a systematic review of recent advances in LATP for SSBs is provided. This review starts with a brief introduction to the development history of LATP and then summarizes its structure, ion transport mechanism, and synthesis methods. Challenges (e.g., intrinsic brittleness, interfacial resistance, and compatibility) and corresponding solutions (ionic substitution, additives, protective layers, composite electrolytes, etc.) that are critical for practical applications are then discussed. Last, an outlook on the future research direction of LATP‐based SSB is provided.