Curing reaction of epoxy resin composed of mixed base resin and curing agent: Experiments and molecular simulation

In this study, we investigated the influence of base resin and curing agent and their mixture on the curing characteristics by performing experiments and molecular simulations. In the curing experiment of epoxy resin, we used differential scanning calorimetry (DSC) to obtain the conversion by mixing curing agents and base resins. We used the molecular orbital method (MO) and the molecular dynamics method (MD) to simulate the curing reaction in molecular scale and investigate the effect of differences in resin composition on the curing characteristics. This simulation took into consideration activation energy, heat of formation, and polarization in the curing reaction. The simulation captures the trend of curing reaction obtained by the experiment. We found that the selection and mixture of curing agents are very important when controlling the curing characteristics of epoxy resin.