Modelling of Mechanical Behavior of Biopolymer Alginate Aerogels Using the Bonded-Particle Model

Molecules. 2019 Jul 12;24(14):2543. doi: 10.3390/molecules24142543.

Abstract

A novel mesoscale modelling approach for the investigation of mechanical properties of alginate aerogels is proposed. This method is based on the discrete element method and bonded-particle model. The nanostructure of aerogel is not directly considered, instead the highly porous structure of aerogels is represented on the mesoscale as a set of solid particles connected by solid bonds. To describe the rheological material behavior, a new elastic-plastic functional model for the solids bonds has been developed. This model has been derived based on the self-similarity principle for the material behavior on the macro and mesoscales. To analyze the effectiveness of the proposed method, the behavior of alginate aerogels with different crosslinking degrees (calcium content) was analyzed. The comparison between experimental and numerical results has shown that the proposed approach can be effectively used to predict the mechanical behavior of aerogels on the macroscale.

Keywords: aerogels; bonded-particle model; discrete element method; mechanical behavior; plastic deformation.

MeSH terms

  • Alginates / chemistry*
  • Algorithms
  • Biopolymers / chemistry*
  • Chemical Phenomena*
  • Elastic Modulus
  • Gels / chemistry*
  • Mechanical Phenomena*
  • Models, Theoretical*

Substances

  • Alginates
  • Biopolymers
  • Gels