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Density functionals with broad applicability in chemistry

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Computational study of the transfer hydrogenation of furfural to furfuryl alcohol in the UiO-66 metal–organic frameworks: mechanistic insights and predictive descriptors for transition states and activation energies

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Tertiary alkanolamines as solvolytic agents for poly(ethylene terephthalate). evaluation of the products as epoxy resin hardeners

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Metal-free recycling of waste polyethylene terephthalate mediated by TBD protic ionic salts: the crucial role of anionic ligands

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Organocatalysed depolymerisation of PET in a fully sustainable cycle using thermally stable protic ionic salt

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Unexpected efficiency of cyclic amidine catalysts in depolymerizing poly(ethylene terephthalate)

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Organocatalysis for versatile polymer degradation

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Molecular-level swelling behaviors of poly (ethylene terephthalate) glycolysis using ionic liquids as catalyst

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