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Fluctuation correction for the order–disorder transition of diblock copolymer melts

T. M. Beardsley, M. W. Matsen

2021The Journal of Chemical Physics25 citationsDOI

Abstract

, using field-theoretic simulations (FTS) supplemented by a partial saddle-point approximation for incompressibility. For computational efficiency, the FTS are performed using the discrete Gaussian-chain model, and results are then mapped onto the continuous model using a linear approximation for the Flory-Huggins χ parameter. Particular attention is paid to the complex phase window. Results are found to be consistent with the well-established understanding that the gyroid phase extends down to the ODT. Furthermore, our simulations are the first to predict that the Fddd phase survives fluctuation effects, consistent with experiments.

Topics & Concepts

GyroidCopolymerPhase transitionThermodynamicsStatistical physicsMaterials scienceGaussianInvariant (physics)PhysicsPolymerQuantum mechanicsComposite materialBlock Copolymer Self-AssemblyTheoretical and Computational PhysicsMaterial Dynamics and Properties
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