Morphology and molecular mobility of plasticized lignins studied with polarization transfer solid-state NMR and SAXS

Two major challenges in processing and applying lignin materials are their rigidity – being brittle at room temperature and lacking flowability when heated – and their heterogeneity, which causes wide and inconsistent variations in thermal properties. External plasticization is a resource-efficient...

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Main Authors: Åke Henrik-Klemens, Tobias Sparrman, Linnea Björn, Aleksandar Matic, Anette Larsson
Format: Article
Language:English
Published: Elsevier 2025-10-01
Series:Polymer Testing
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Online Access:http://www.sciencedirect.com/science/article/pii/S0142941825002569
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author Åke Henrik-Klemens
Tobias Sparrman
Linnea Björn
Aleksandar Matic
Anette Larsson
author_facet Åke Henrik-Klemens
Tobias Sparrman
Linnea Björn
Aleksandar Matic
Anette Larsson
author_sort Åke Henrik-Klemens
collection DOAJ
description Two major challenges in processing and applying lignin materials are their rigidity – being brittle at room temperature and lacking flowability when heated – and their heterogeneity, which causes wide and inconsistent variations in thermal properties. External plasticization is a resource-efficient way to improve the processability and mechanical properties of lignin and lignin-containing materials. However, how plasticizers distribute themselves within the lignin matrix and change its molecular superstructure is not known. In this work, the dispersal of plasticizer and its effect on lignin morphology and molecular mobility were studied using polarization transfer solid-state NMR (ssNMR) and small-angle X-ray scattering (SAXS). Two softwood lignins (Lignoboost and isolated from Norway spruce) were plasticized with three different plasticizers (glycerol, triacetin and diethyl phthalate). The molecular mobility of lignin-plasticizer blends under the glass transition temperature was found to differ substantially, with aprotic plasticizers enabling higher mobility in both types of lignins. The spin diffusion of lignin prior to plasticization was heterogeneous, indicating a heterogeneous chemical environment in the low nanometer range. Upon plasticization, the heterogeneity remained but changed in character. Plasticizer was now distributed unevenly between two lignin phases, but the two phases had achieved more similar dynamics. This convergence suggests the formation of a material with narrower range in physical properties – in line with the observed narrowing of the glass transition upon plasticization. Lignin blended with highly compatible plasticizers were found to have a more swollen morphology as revealed by SAXS. These findings indicate that an appropriate plasticizer will both reduce the temperature and the width of the glass transition, yield a more homogeneous material as well as form a glass that can accommodate stress.
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spelling doaj-art-c539165ac86c43bfa84f6062a8265bf72025-08-20T03:39:04ZengElsevierPolymer Testing1873-23482025-10-0115110894210.1016/j.polymertesting.2025.108942Morphology and molecular mobility of plasticized lignins studied with polarization transfer solid-state NMR and SAXSÅke Henrik-Klemens0Tobias Sparrman1Linnea Björn2Aleksandar Matic3Anette Larsson4Applied Chemistry, Chemistry and Chemical Engineering, Chalmers University of Technology, SE-412 96, Gothenburg, Sweden; FibRe – Centre for Lignocellulose-based Thermoplastics, Department of Chemistry and Chemical Engineering, Chalmers University of Technology, SE-412 96, Gothenburg, SwedenDepartment of Chemistry, Umeå University, SE-901 87, Umeå, SwedenFibRe – Centre for Lignocellulose-based Thermoplastics, Department of Chemistry and Chemical Engineering, Chalmers University of Technology, SE-412 96, Gothenburg, Sweden; Materials Physics, Physics, Chalmers University of Technology, SE-412 96, Gothenburg, SwedenFibRe – Centre for Lignocellulose-based Thermoplastics, Department of Chemistry and Chemical Engineering, Chalmers University of Technology, SE-412 96, Gothenburg, Sweden; Materials Physics, Physics, Chalmers University of Technology, SE-412 96, Gothenburg, SwedenApplied Chemistry, Chemistry and Chemical Engineering, Chalmers University of Technology, SE-412 96, Gothenburg, Sweden; FibRe – Centre for Lignocellulose-based Thermoplastics, Department of Chemistry and Chemical Engineering, Chalmers University of Technology, SE-412 96, Gothenburg, Sweden; Wallenberg Wood Science Center, Chalmers University of Technology, SE-412 96, Gothenburg, Sweden; Corresponding author. Applied Chemistry, Chemistry and Chemical Engineering, Chalmers University of Technology, SE-412 96, Gothenburg, Sweden.Two major challenges in processing and applying lignin materials are their rigidity – being brittle at room temperature and lacking flowability when heated – and their heterogeneity, which causes wide and inconsistent variations in thermal properties. External plasticization is a resource-efficient way to improve the processability and mechanical properties of lignin and lignin-containing materials. However, how plasticizers distribute themselves within the lignin matrix and change its molecular superstructure is not known. In this work, the dispersal of plasticizer and its effect on lignin morphology and molecular mobility were studied using polarization transfer solid-state NMR (ssNMR) and small-angle X-ray scattering (SAXS). Two softwood lignins (Lignoboost and isolated from Norway spruce) were plasticized with three different plasticizers (glycerol, triacetin and diethyl phthalate). The molecular mobility of lignin-plasticizer blends under the glass transition temperature was found to differ substantially, with aprotic plasticizers enabling higher mobility in both types of lignins. The spin diffusion of lignin prior to plasticization was heterogeneous, indicating a heterogeneous chemical environment in the low nanometer range. Upon plasticization, the heterogeneity remained but changed in character. Plasticizer was now distributed unevenly between two lignin phases, but the two phases had achieved more similar dynamics. This convergence suggests the formation of a material with narrower range in physical properties – in line with the observed narrowing of the glass transition upon plasticization. Lignin blended with highly compatible plasticizers were found to have a more swollen morphology as revealed by SAXS. These findings indicate that an appropriate plasticizer will both reduce the temperature and the width of the glass transition, yield a more homogeneous material as well as form a glass that can accommodate stress.http://www.sciencedirect.com/science/article/pii/S0142941825002569LigninPlasticizerGlass transitionSolid-state NMRSpin-lattice relaxationSAXS
spellingShingle Åke Henrik-Klemens
Tobias Sparrman
Linnea Björn
Aleksandar Matic
Anette Larsson
Morphology and molecular mobility of plasticized lignins studied with polarization transfer solid-state NMR and SAXS
Polymer Testing
Lignin
Plasticizer
Glass transition
Solid-state NMR
Spin-lattice relaxation
SAXS
title Morphology and molecular mobility of plasticized lignins studied with polarization transfer solid-state NMR and SAXS
title_full Morphology and molecular mobility of plasticized lignins studied with polarization transfer solid-state NMR and SAXS
title_fullStr Morphology and molecular mobility of plasticized lignins studied with polarization transfer solid-state NMR and SAXS
title_full_unstemmed Morphology and molecular mobility of plasticized lignins studied with polarization transfer solid-state NMR and SAXS
title_short Morphology and molecular mobility of plasticized lignins studied with polarization transfer solid-state NMR and SAXS
title_sort morphology and molecular mobility of plasticized lignins studied with polarization transfer solid state nmr and saxs
topic Lignin
Plasticizer
Glass transition
Solid-state NMR
Spin-lattice relaxation
SAXS
url http://www.sciencedirect.com/science/article/pii/S0142941825002569
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