Complex Implications of Translational Invariance in Polymer Field Theory

The behavior of complex-Langevin field-theoretic simulations (CL-FTSs) of polymer liquids is sensitive to the nature of saddle-point field configurations, which are solutions of self-consistent field theory (SCFT). Recent work [Kang et al. Macromolecules 2024, 57, 3850] has shown that SCFT saddle-points with real fields are generally not isolated solutions but rather members of a low-dimensional family of continuously connected complex-valued saddle-points sharing the same Hamiltonian value. We show that this behavior is a natural consequence of the analyticity and translational invariance of the Hamiltonian, which together demand its invariance under generalized translations by displacements with complex components. We also present a numerical algorithm that minimizes the deleterious effects of this generalized symmetry on the stability of CL-FTSs.

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Publication Details

Journal
Macromolecules
Published
2024-10-07
DOI
https://doi.org/10.1021/acs.macromol.4c01617
Citations
2
Primary Topic
Block Copolymer Self-Assembly
Type
article
Field-Weighted Citation Impact
0.23

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article

Complex Implications of Translational Invariance in Polymer Field Theory

Jaeup U. Kim, James D. Willis, David C. Morse, M. W. Matsen
2 citations
Macromolecules
Block Copolymer Self-Assembly
0.23
article

Complex Implications of Translational Invariance in Polymer Field Theory

Jaeup U. Kim, James D. Willis, David C. Morse, M. W. Matsen
article en
2 citations

Abstract

The behavior of complex-Langevin field-theoretic simulations (CL-FTSs) of polymer liquids is sensitive to the nature of saddle-point field configurations, which are solutions of self-consistent field theory (SCFT). Recent work [Kang et al. Macromolecules 2024, 57, 3850] has shown that SCFT saddle-points with real fields are generally not isolated solutions but rather members of a low-dimensional family of continuously connected complex-valued saddle-points sharing the same Hamiltonian value. We show that this behavior is a natural consequence of the analyticity and translational invariance of the Hamiltonian, which together demand its invariance under generalized translations by displacements with complex components. We also present a numerical algorithm that minimizes the deleterious effects of this generalized symmetry on the stability of CL-FTSs.

MacromoleculesVol. 57(20)
University of Minnesota (US), University of Waterloo (CA), Ulsan National Institute of Science and Technology (KR)
National Research Foundation of Korea, Alliance de recherche numérique du Canada, Natural Sciences and Engineering Research Council of Canada, Office of Advanced Cyberinfrastructure
Openalex Percentile: Top 51%
Block Copolymer Self-Assembly
0.23
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