Diffusion coefficient Dα of polymer obtained by MD simulations in the NVTE statistical ensemble.
Regime | t (fs) | α | (Dα) (cm2 s−α) |
---|---|---|---|
Mushroom | [0, 105.2] | 0.50 | 2.8 × 10−4 |
[105.2, 107] | 1 | 1.4 × 10−6 | |
Brush | [0, 105.4] | 0.34 | 2.2 × 10−4 |
[105.4, 107] | 1 | 8.5 × 10−7 |