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. 2024 Oct 21;15:9079. doi: 10.1038/s41467-024-53304-3

Fig. 7. Molecular dynamic simulation of the interaction between NBs and NPs.

Fig. 7

The final equilibrium attachment states for a PS6B6, b PS6B15, c PS6B20, d PE12B6 e PS12B6, f PS12B15, g PS12B20, and h PET12B6. The water and NPs are shown as transparent and opaque surfaces, respectively, while N2 molecules are not shown for clarity. i Interaction energy between NBs and NPs with respect to different sizes and NP composition. j Local (left, line) and cumulative (right, dot) distribution profiles between a 6 nm NP and N2 NBs of various sizes. k Local (left, line) and cumulative (right, dot) distribution profiles between a 12 nm NP and N2 NBs of different sizes.