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scopus(9)
Correction: Expanding plastics recycling technologies: chemical aspects, technology status and challenges (Green Chemistry (2022) 24 (8899-9002) DOI: 10.1039/D2GC02588D)
OtherAbstract: Correction for ‘Expanding plastics recycling technologies: chemical aspects, technology status and cPalabras claves:Autores:Aguirre-Villegas H.A., Allen R.D., Bai X., Beckham G.T., Benson C.H., Bradshaw S.L., Brown J.L., Brown R.C., Cecon V.S., Curley J.B., Curtzwiler G.W., Dong S., Estela-García J.E., Gaddameedi S., Hermans I., Huber G.W., Kim M.S., Li H., Ma J., Mark L.O., Mavrikakis M., Olafasakin O.O., Osswald T.A., Papanikolaou K.G., Radhakrishnan H., Sanchez Castillo M.A., Sánchez-Rivera K.L., Tumu K.N., Van Lehn R.C., Víctor M. Zavala, Vorst K.L., Wright M.M., Wu J., Zhou P.Fuentes:scopusFast pbkp_redictions of liquid-phase acid-catalyzed reaction rates using molecular dynamics simulations and convolutional neural networks
ArticleAbstract: The rates of liquid-phase, acid-catalyzed reactions relevant to the upgrading of biomass into high-vPalabras claves:Autores:Chew A.K., Jiang S., Van Lehn R.C., Víctor M. Zavala, Zhang W.Fuentes:scopusExpanding plastics recycling technologies: chemical aspects, technology status and challenges
ReviewAbstract: Less than 10% of the plastics generated globally are recycled, while the rest are incinerated, accumPalabras claves:Autores:Aguirre-Villegas H.A., Allen R.D., Bai X., Beckham G.T., Benson C.H., Bradshaw S.L., Brown J.L., Brown R.C., Cecon V.S., Curley J.B., Curtzwiler G.W., Dong S., Gaddameedi S., García J.E., Hermans I., Huber G.W., Kim M.S., Li H., Ma J., Mark L.O., Mavrikakis M., Olafasakin O.O., Osswald T.A., Papanikolaou K.G., Radhakrishnan H., Sanchez Castillo M.A., Sánchez-Rivera K.L., Tumu K.N., Van Lehn R.C., Víctor M. Zavala, Vorst K.L., Wright M.M., Wu J., Zhou P.Fuentes:scopusOn the integration of molecular dynamics, data science, and experiments for studying solvent effects on catalysis
ReviewAbstract: Computational workflows that combine molecular dynamics (MD) simulations and emerging data-centric (Palabras claves:Autores:Huber G.W., Je L., Van Lehn R.C., Víctor M. ZavalaFuentes:scopusOrdering Transitions of Liquid Crystals Triggered by Metal Oxide-catalyzed Reactions of Sulfur Oxide Species
ArticleAbstract: Liquid crystals (LCs), when supported on reactive surfaces, undergo changes in ordering that can proPalabras claves:Autores:Abbott N.L., Bao N., Gold J.I., Mavrikakis M., Schauer J.J., Sheavly J.K., Van Lehn R.C., Víctor M. ZavalaFuentes:scopusSensing Gas Mixtures by Analyzing the Spatiotemporal Optical Responses of Liquid Crystals Using 3D Convolutional Neural Networks
ArticleAbstract: We report how analysis of the spatial and temporal optical responses of liquid crystal (LC) films toPalabras claves:Color Features, gas sensor, Liquid crystals, Machine learning, Spatiotemporal patternsAutores:Abbott N.L., Bao N., Jiang S., Mavrikakis M., Schauer J.J., Smith A.D., Van Lehn R.C., Víctor M. ZavalaFuentes:scopusReducing Antisolvent Use in the STRAP Process by Enabling a Temperature-Controlled Polymer Dissolution and Precipitation for the Recycling of Multilayer Plastic Films
ArticleAbstract: The recently reported processing strategy called solvent-targeted recovery and precipitation (STRAP)Palabras claves:molecular simulation, plastics recycling, polymer solubility, Process design, process economicsAutores:González Chávez L.D., Grey S., Hermans I., Huber G.W., Kim M.S., Nelson K., Sánchez-Rivera K.L., Van Lehn R.C., Víctor M. Zavala, Wang S.C., Zhou P.Fuentes:scopusPbkp_redicting Critical Micelle Concentrations for Surfactants Using Graph Convolutional Neural Networks
ArticleAbstract: Surfactants are amphiphilic molecules that are widely used in consumer products, industrial processePalabras claves:Autores:Jin T., Qin S., Van Lehn R.C., Víctor M. ZavalaFuentes:scopusTopological Analysis of Molecular Dynamics Simulations using the Euler Characteristic
ArticleAbstract: Molecular dynamics (MD) simulations are used in diverse scientific and engineering fields such as drPalabras claves:Autores:Chew A.K., Kelkar A.S., Maheshwari U., Runde S., Smith A.D., Van Lehn R.C., Víctor M. ZavalaFuentes:scopus