Phason-Driven Diversity of Nucleation Pathways in Icosahedral Quasicrystals

Fuente: arXiv
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Main Authors: Cui, Gang, Zhang, Lei, Zhang, Pingwen, Shi, An-Chang, Jiang, Kai
Format: Preprint
Published: 2026
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author Cui, Gang
Zhang, Lei
Zhang, Pingwen
Shi, An-Chang
Jiang, Kai
author_facet Cui, Gang
Zhang, Lei
Zhang, Pingwen
Shi, An-Chang
Jiang, Kai
contents The nucleation of quasicrystals remains a fundamental puzzle, primarily due to the absence of a periodic translational template. Here, we demonstrate that phasons - hidden degrees of freedom unique to quasiperiodic order - drive diverse nucleation pathways in icosahedral quasicrystals (IQCs). Combining a Landau free-energy model with the spring pair method, we compute distinct critical nuclei and their corresponding minimum energy paths. At low temperatures, a direct, symmetry-preserving pathway dominates. In contrast, higher temperatures promote a "symmetry detour" that reduces the nucleation barrier via a lower-symmetry critical nucleus. Remarkably, while the resulting bulk IQCs exhibit distinct real-space symmetries, they remain thermodynamically degenerate with identical diffraction patterns. We resolve this paradox within the high-dimensional projection framework, showing that phason shifts modulate real-space symmetry without altering bulk thermodynamics. Our findings establish phasons as the structural origin of pathway diversity, offering a new physical picture for the emergence of quasiperiodic order.
format Preprint
id arxiv_https___arxiv_org_abs_2602_13969
institution arXiv
publishDate 2026
record_format arxiv
spellingShingle Phason-Driven Diversity of Nucleation Pathways in Icosahedral Quasicrystals
Cui, Gang
Zhang, Lei
Zhang, Pingwen
Shi, An-Chang
Jiang, Kai
Soft Condensed Matter
Computational Physics
The nucleation of quasicrystals remains a fundamental puzzle, primarily due to the absence of a periodic translational template. Here, we demonstrate that phasons - hidden degrees of freedom unique to quasiperiodic order - drive diverse nucleation pathways in icosahedral quasicrystals (IQCs). Combining a Landau free-energy model with the spring pair method, we compute distinct critical nuclei and their corresponding minimum energy paths. At low temperatures, a direct, symmetry-preserving pathway dominates. In contrast, higher temperatures promote a "symmetry detour" that reduces the nucleation barrier via a lower-symmetry critical nucleus. Remarkably, while the resulting bulk IQCs exhibit distinct real-space symmetries, they remain thermodynamically degenerate with identical diffraction patterns. We resolve this paradox within the high-dimensional projection framework, showing that phason shifts modulate real-space symmetry without altering bulk thermodynamics. Our findings establish phasons as the structural origin of pathway diversity, offering a new physical picture for the emergence of quasiperiodic order.
title Phason-Driven Diversity of Nucleation Pathways in Icosahedral Quasicrystals
topic Soft Condensed Matter
Computational Physics
url https://arxiv.org/abs/2602.13969