Particle-Mediated Tuning of Defect Stability in Lamellar Block Copolymer Systems

Abstract We study how colloidal inclusions modify the formation energy of dislocation pairs in lamellar block copolymer systems. Using a hybrid particle/Ginzburg–Landau model, we calculate defect formation energies by comparing defect-free and defect-containing states with and without embedded colloids. Finite-size scaling is used to obtain formation energies in the thermodynamic limit. The effect of colloid insertion depends strongly on particle sizes and surface patterning. Homogeneous particles increasingly stabilize dislocation pairs with increasing particle sizes. Particles larger than one lamellar domain preferentially occupy the dislocation cores, where they replace strained polymer rather than deforming defect-free lamellae. The magnitude of this stabilization depends on surface affinity. Balanced Janus particles instead increase the formation energy, because their competing surface preferences cannot be satisfied simultaneously near the curved core. Varying the patch ratio interpolates between these limits. Surface patterning has little effect for particles smaller than one lamellar domain, but changes the formation energy by several tens of reduced energy units (roughly 10–40 kBT for typical block copolymers) for larger particles. These results provide quantitative guidelines for controlling topological defect stability in lamellar block copolymer systems.

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Publication Details

Journal
Macromolecules
Published
2026-11-02
DOI
https://doi.org/10.1021/acs.macromol.6c02458
Primary Topic
Block Copolymer Self-Assembly
Type
article
Field-Weighted Citation Impact
0.00

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article

Particle-Mediated Tuning of Defect Stability in Lamellar Block Copolymer Systems

Le Qiao, Friederike Schmid, Daniel A. Vega
Macromolecules
Block Copolymer Self-Assembly
article

Particle-Mediated Tuning of Defect Stability in Lamellar Block Copolymer Systems

Le Qiao, Friederike Schmid, Daniel A. Vega
article en

Abstract

Abstract We study how colloidal inclusions modify the formation energy of dislocation pairs in lamellar block copolymer systems. Using a hybrid particle/Ginzburg–Landau model, we calculate defect formation energies by comparing defect-free and defect-containing states with and without embedded colloids. Finite-size scaling is used to obtain formation energies in the thermodynamic limit. The effect of colloid insertion depends strongly on particle sizes and surface patterning. Homogeneous particles increasingly stabilize dislocation pairs with increasing particle sizes. Particles larger than one lamellar domain preferentially occupy the dislocation cores, where they replace strained polymer rather than deforming defect-free lamellae. The magnitude of this stabilization depends on surface affinity. Balanced Janus particles instead increase the formation energy, because their competing surface preferences cannot be satisfied simultaneously near the curved core. Varying the patch ratio interpolates between these limits. Surface patterning has little effect for particles smaller than one lamellar domain, but changes the formation energy by several tens of reduced energy units (roughly 10–40 kBT for typical block copolymers) for larger particles. These results provide quantitative guidelines for controlling topological defect stability in lamellar block copolymer systems.

Macromolecules
Johannes Gutenberg University Mainz (DE), Universidad Nacional del Sur (AR)
Deutsche Forschungsgemeinschaft, Johannes Gutenberg-Universität Mainz
Openalex Percentile: Top 52%
Block Copolymer Self-Assembly
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