▎ 摘　　要

NOVELTY - Smart designing graphene oxide/calcium-silicate-hydrate (C-S-H) gel composite material based on molecular dynamics theory comprises performing designing method based on molecular dynamics theory, where the force field is experience force field, and the model is composed of C-S-H gel and graphene oxide. USE - The method is useful for smart designing graphene oxide/calcium-silicate-hydrate gel composite material based on molecular dynamics theory. ADVANTAGE - The method: quantifies the structure, dynamics and mechanical properties of graphene oxide/C-S-H nanocomposites; and achieves the purpose of rapid, and low-cost material orientation design.