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. 2022 Mar 14;14(6):1161. doi: 10.3390/polym14061161

Figure 4.

Figure 4

The plots of (a) temperature, (b) total energy (Etot), (c) Van der Waals energy (EvdW), (d) Coulombic energy (ECou), and (e) end-to-end distance and its probability distribution for single-chain polymers PET and PEV along the simulation time at temperatures 100–600 K.