Fluctuation correction for the critical transition of symmetric homopolymer blends.

J Chem Phys

Department of Chemical Engineering, Department of Physics and Astronomy, and Waterloo Institute for Nanotechnology, University of Waterloo, Waterloo, Ontario N2L 3G1, Canada.

Published: July 2017

Monte Carlo simulations are performed on structurally symmetric binary homopolymer blends over a wide range of invariant polymerization indices, N¯. A finite-size scaling analysis reveals that certain critical exponents deviate from the expected 3D-Ising values as N¯ increases. However, the deviations are consistent with previous simulations and can be attributed to the fact that the system crosses over to mean-field behavior when the molecules become too large relative to the size of the simulation box. Nevertheless, the finite-size scaling techniques provide precise predictions for the position of the critical transition. Using a previous calibration of the Flory-Huggins interaction parameter, χ, we confirm that the critical point scales as (χN)=2+cN¯ for large N¯, and more importantly we are able to extract a reliable estimate, c≈1.5, for the universal constant.

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http://dx.doi.org/10.1063/1.4995260DOI Listing

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