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Phason-Driven Diversity of Nucleation Pathways in Icosahedral Quasicrystals

Soft Condensed Matter 2026-02-17 v1 Computational Physics

Abstract

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.

Keywords

Cite

@article{arxiv.2602.13969,
  title  = {Phason-Driven Diversity of Nucleation Pathways in Icosahedral Quasicrystals},
  author = {Gang Cui and Lei Zhang and Pingwen Zhang and An-Chang Shi and Kai Jiang},
  journal= {arXiv preprint arXiv:2602.13969},
  year   = {2026}
}