期刊
JOURNAL OF MOLECULAR LIQUIDS
卷 376, 期 -, 页码 -出版社
ELSEVIER
DOI: 10.1016/j.molliq.2023.121465
关键词
Cellulose hydrogels; Ionic liquid; Gelation temperature; Gel physicochemical properties; NMR; Molecular dynamics simulation
Cellulose hydrogels were prepared using cellulose/1-butyl-3-methylimidazolium acetate/dimethyl sulfoxide at temperatures ranging from 5 to 60 degrees C. The relationship between gelation temperature and physicochemical properties of the gel was investigated. Interactions between cellulose and ionic liquids and between cellulose and cellulose were studied using molecular simulations, nuclear magnetic resonance, and density functional theory calculations, providing insights into the effects of gelation temperature on gel properties.
In this study, cellulose hydrogels were produced using cellulose/1-butyl-3-methylimidazolium acetate/ dimethyl sulfoxide at temperatures ranging from 5 to 60 degrees C. The relationship between the gelation tem-perature and physicochemical properties of the prepared gel (shrinkage rate, water content, crystallinity index, and mechanical strength) was thoroughly investigated. In addition, the interactions between cel-lulose and ionic liquids and between cellulose and cellulose were investigated using dynamic molecular simulations, nuclear magnetic resonance, and density functional theory calculations, and the effects of gelation temperature on gel physicochemical properties were elucidated from a molecular theoretical perspective. (c) 2023 Elsevier B.V. All rights reserved.
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