Under temperature stress, high-strength mass concrete is brittle due to its high total heat of hydration. In this study, a control mixture of C55 high-strength mass concrete meeting the performance requirements was prepared. The effects of different functional aggregates on the thermal properties, such as setting and hardening rate, peak temperature, and temperature rise and fall rate in the early stage of cement hydration, as well as the effects of functional lightweight aggregates on the workability, mechanical properties, and deformation properties of concrete, were investigated in this paper using two types of aggregates with thermal insulation and phase change energy storage functions. The study shows that, in addition to having some early strength impacts and temperature management capabilities, thermal storage coarse lightweight aggregate (PCCLA) and thermal insulation fine lightweight aggregate (TIFLA) can both increase the workability and crack resistance of concrete. When it comes to temperature regulation, thermal storage coarse aggregate outperforms thermal insulation functional aggregate significantly. Thermal insulation fine aggregate can improve the rate of setting and hardening, while coarse thermal storage aggregate may work as in-situ self-heating curing in the early stages due to its phase change energy storage. This quickens the rate of setting and hardening and increases the resistivity of the set period, which in turn increases the rate of drying shrinkage.