• 文献标题:   Multi-scale analysis of thermoelastic properties of graphene foam/PDMS composites
  • 文献类型:   Article
  • 作  者:   KHOSRAVANI S, SADR MH, CARRERA E, PAGANI A, SANCHEZMAJANO AR
  • 作者关键词:   graphene foam, cte, specific heat, lammps software, cuf microthermoelastic model, multiscale modeling
  • 出版物名称:   COMPUTATIONAL MATERIALS SCIENCE
  • ISSN:   0927-0256 EI 1879-0801
  • 通讯作者地址:  
  • 被引频次:   0
  • DOI:   10.1016/j.commatsci.2022.111842
  • 出版年:   2023

▎ 摘  要

In macroscopic applications, the production of graphene foam (GF) can be an attractive way to utilize the combined advantages of graphene sheets and porous materials. The porosity level significantly affects mechanical and thermal properties by changing the specific surface area. In this study, a multi-scale method is used to calculate the coefficient of thermal expansion (CTE) and heat capacity of GF/polymer composites. Molecular dynamics have calculated the properties of 3D GFs. In particular, four types of GF with increasing mass density and decreasing porosity are investigated. The thermoelastic properties are calculated as temperature-dependent for all groups of GF. Mechanics of structure genome (MSG) based on Carrera unified formulation (CUF) is used to calculate the effective properties of the GF/polymer composites. It was found that the composite consisting of GF with the highest density and lowest porosity has the minimum CTE. Also, the heat capacity of the composite depends not only on the heat capacity of the components but also on their Young modulus, CTE, and geometry.