Construction of Three-Dimensional Network Structure in Polyethylene-EPDM-Based Phase Change Materials by Carbon Nanotube with Enhanced Thermal Conductivity, Mechanical Property and Photo-Thermal Conversion Performance.

High thermal conductivity and good mechanical properties are significant for photo-thermal conversion in solar energy utilization. In this work, we constructed a three-dimensional network structure in polyethylene (PE) and ethylene-propylene-diene monomer (EPDM)-based phase change composites by mixing with a carbon nanotube (CNT). Two-dimensional flake expanded graphite in PE-EPDM-based phase change materials and one-dimensional CNT were well mixed to build dense three-dimensional thermal pathways. We show that CNT (5.40%wt)-PE-EPDM phase change composites deliver excellent thermal conductivity (3.11 W m-1 K-1) and mechanical properties, with tensile and bending strength of 10.19 and 21.48 MPa. The melting and freezing temperature of the optimized phase change composites are measured to be 64.5 and 64.2 °C and the melting and freezing latent enthalpy are measured to be 130.3 and 130.5 J g-1. It is found that the composite phase change material with high thermal conductivity is conducive to the rapid storage of solar energy, so as to improve the efficiency of heat collection.

Molecular Dynamics Simulation Study on the Growth of Structure II Nitrogen Hydrate.

Crystal growth of N2 hydrate in a three-phase system consisting of N2 hydrate, liquid water, and gaseous N2 was performed by molecular dynamics simulation at 260 K. Pressure influence on hydrate growth was evaluated. The kinetic properties including the growth rates and cage occupancies of the newly formed hydrate and the diffusion coefficient and concentration of N2 molecules in liquid phase were measured. The results showed that the growth of N2 hydrate could be divided into two stages where N2 molecules in gas phase had to dissolve in liquid phase and then form hydrate cages at the liquid-hydrate interface. The diffusion coefficient and concentration of N2 in liquid phase increased linearly with increasing pressure. As the pressure rose from 50 to 100 MPa, the hydrate growth rate kept increasing from 0.11 to 0.62 cages·ns-1·Å-2 and then dropped down to around 0.40 cages·ns-1·Å-2 once the pressure surpassed 100 MPa. During the hydrate formation, the initial sII N2 hydrate phase set in the system served as a template for the subsequent growth of N2 hydrate so that no new crystal structure was found. Analysis on the cage occupancies revealed that the amount of cages occupied by two N2 molecules increased evidently when the pressure was above 100 MPa, which slowed down the growth rate of hydrate cages. Additionally, a small fraction of defective cages including two N2 molecules trapped in 51265 cages and three N2 molecules trapped 51268 cages was observed during the hydrate growth.