Nonequilibrium processes in polymer membrane formation: Theory and experiment

M Müller, V Abetz - Chemical reviews, 2021 - ACS Publications
Porous polymer and copolymer membranes are useful for ultrafiltration of functional
macromolecules, colloids, and water purification. In particular, block copolymer membranes …

Process-directed self-assembly of copolymers: Results of and challenges for simulation studies

M Müller - Progress in Polymer Science, 2020 - Elsevier
Process-directed self-assembly refers to processes that reproducibly trap the kinetics of
structure formation that ensues after a sudden change (“quench”) of the thermodynamic …

50th Anniversary Perspective: Block PolymersPure Potential

CM Bates, FS Bates - Macromolecules, 2017 - ACS Publications
Block polymers have undergone extraordinary evolution since their inception more than 60
years ago, maturing from simple surfactants to an expansive class of macromolecules …

Strong scaling of general-purpose molecular dynamics simulations on GPUs

J Glaser, TD Nguyen, JA Anderson, P Lui… - Computer Physics …, 2015 - Elsevier
We describe a highly optimized implementation of MPI domain decomposition in a GPU-
enabled, general-purpose molecular dynamics code, HOOMD-blue (Anderson and Glotzer …

High χ–Low N Block Polymers: How Far Can We Go?

C Sinturel, FS Bates, MA Hillmyer - 2015 - ACS Publications
Block polymers incorporating highly incompatible segments are termed “high χ” polymers,
where χ is the Flory–Huggins interaction parameter. These materials have attracted a great …

Frank–Kasper phases in block polymers

KD Dorfman - Macromolecules, 2021 - ACS Publications
The discovery of the Frank–Kasper σ phase in diblock copolymer and tetrablock terpolymer
melts catalyzed a renewed interest over the past decade in understanding particle-forming …

Stability of the A15 phase in diblock copolymer melts

MW Bates, J Lequieu, SM Barbon… - Proceedings of the …, 2019 - National Acad Sciences
The self-assembly of block polymers into well-ordered nanostructures underpins their utility
across fundamental and applied polymer science, yet only a handful of equilibrium …

Understanding and modeling polymers: The challenge of multiple scales

F Schmid - ACS Polymers Au, 2022 - ACS Publications
Polymer materials are multiscale systems by definition. Already the description of a single
macromolecule involves a multitude of scales, and cooperative processes in polymer …

Broadly accessible self-consistent field theory for block polymer materials discovery

A Arora, J Qin, DC Morse, KT Delaney… - …, 2016 - ACS Publications
Self-consistent field theory (SCFT) is a powerful tool for the design and interpretation of
experiments on block polymer materials. In this Perspective, we lower the barrier to entry to …

[HTML][HTML] Theory of polyelectrolyte complexation—Complex coacervates are self-coacervates

KT Delaney, GH Fredrickson - The Journal of chemical physics, 2017 - pubs.aip.org
The complexation of mixtures of cationic and anionic polymers to produce complex-
coacervate phases is a subject of fundamental importance to colloid and polymer science as …