The role of urea in the solubility of cellulose in aqueous quaternary ammonium hydroxide.


Journal

RSC advances
ISSN: 2046-2069
Titre abrégé: RSC Adv
Pays: England
ID NLM: 101581657

Informations de publication

Date de publication:
04 Feb 2020
Historique:
received: 01 10 2019
accepted: 30 01 2020
entrez: 2 5 2022
pubmed: 6 2 2020
medline: 6 2 2020
Statut: epublish

Résumé

We examine the role of water and urea in cellulose solubility in tetrabutylammonium hydroxide (TBAH). Molecular dynamics simulations were performed for several different solvent compositions with a fixed cellulose fraction. For each composition, two simulations were carried out with cellulose fixed in each of the crystalline and the dissolved states. From the enthalpy and the entropy of the two states, the difference in Gibbs free energy (Δ

Identifiants

pubmed: 35497420
doi: 10.1039/c9ra07989k
pii: c9ra07989k
pmc: PMC9049597
doi:

Types de publication

Journal Article

Langues

eng

Pagination

5919-5929

Informations de copyright

This journal is © The Royal Society of Chemistry.

Déclaration de conflit d'intérêts

There are no conflicts to declare.

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Auteurs

Mikayla G Walters (MG)

Department of Chemical & Biomolecular Engineering, The University of South Alabama Mobile Alabama 36688 USA brabideau@southalabama.edu +1 251 461 1485 +1 251 460 7147.

Albaraa D Mando (AD)

Department of Chemical & Biomolecular Engineering, The University of South Alabama Mobile Alabama 36688 USA brabideau@southalabama.edu +1 251 461 1485 +1 251 460 7147.

W Matthew Reichert (W)

Department of Chemistry, The University of South Alabama Mobile Alabama 36688 USA.

Christy W West (CW)

Department of Chemical & Biomolecular Engineering, The University of South Alabama Mobile Alabama 36688 USA brabideau@southalabama.edu +1 251 461 1485 +1 251 460 7147.

Kevin N West (KN)

Department of Chemical & Biomolecular Engineering, The University of South Alabama Mobile Alabama 36688 USA brabideau@southalabama.edu +1 251 461 1485 +1 251 460 7147.

Brooks D Rabideau (BD)

Department of Chemical & Biomolecular Engineering, The University of South Alabama Mobile Alabama 36688 USA brabideau@southalabama.edu +1 251 461 1485 +1 251 460 7147.

Classifications MeSH