Abstract
We studied the percolation process in a system consisting of long flexible polymer chains and solvent molecules. The polymer chains were approximated by linear sequences of beads on a two-dimensional triangular lattice. The system was athermal and the excluded volume was the only potential. The properties of the model system across the entire range of polymer concentrations were determined by Monte Carlo simulations employing a cooperative motion algorithm (CMA). The scaling behavior and the structure of the percolation clusters are presented and discussed.
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The computational part of this work was done using the computer cluster at the Computing Center of the Department of Chemistry at the University of Warsaw.
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Sikorski, A., Polanowski, P., Adamczyk, P. et al. The structure of percolated polymer systems: a computer simulation study. J Mol Model 17, 2209–2215 (2011). https://doi.org/10.1007/s00894-011-0984-9
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DOI: https://doi.org/10.1007/s00894-011-0984-9