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Identifying a critical micelle temperature in simulations of disordered asymmetric diblock copolymer melts

Anshul Chawla, Frank S. Bates, Kevin D. Dorfman*, and David C. Morse†

  • Department of Chemical Engineering and Materials Science, University of Minnesota, 421 Washington Avenue SE, Minneapolis, Minnesota 55455, USA

  • *dorfman@umn.edu
  • †morse012@umn.edu

Phys. Rev. Materials 5, L092601 – Published 9 September, 2021

DOI: https://doi.org/10.1103/PhysRevMaterials.5.L092601

Abstract

Experiments on asymmetric diblock copolymers at temperatures slightly above the order-disorder transition (ODT) temperature indicate the existence of a dense fluid of micelles. Molecular dynamics simulations are used here to identify a higher critical micelle temperature below which micelles appear. The onset of micellization occurs very near where self-consistent field theory predicts an ODT.

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