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- W4372311859 endingPage "122030" @default.
- W4372311859 startingPage "122030" @default.
- W4372311859 abstract "Hydrolysis lignin was treated with sub- and supercritical water (523–723 K and 10 MPa). As a result, depolymerization of lignin to mono- and oligolignols occurs. SEC data show water-soluble particles up to 4 nm after treatment of lignin by subcritical water (523 K and 10 MPa). After further treatment with supercritical water (723 K and 10 MPa), the concentration of water-soluble particles decreases by 2–3 times; and their size increased up to 10 nm. Molecular dynamics simulation of a model lignin particle in aqueous medium under standard (298 K, ρ = 0.997 g/cm3) and supercritical (673 K, ρ = 0.133 g/cm3) conditions was performed. Based on modeling, lignol monomers surrounded by solvate shells and water-soluble particles of lignin oligomers with a gel-like structure were identified as the structural units of the solutions. Under supercritical conditions, it causes the different ways of transformation of the system: further destruction of individual lignol molecules or condensation of lignols with the formation of insoluble precipitate." @default.
- W4372311859 created "2023-05-07" @default.
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- W4372311859 date "2023-08-01" @default.
- W4372311859 modified "2023-10-06" @default.
- W4372311859 title "Structure of aqueous solutions of lignin treated by sub- and supercritical water: Experiment and simulation" @default.
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- W4372311859 doi "https://doi.org/10.1016/j.molliq.2023.122030" @default.
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