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Structure · dataset · 2026

Lattice Parameter Governs Magnetic Ground State Selection in Tsai-Type Intermetallic Compounds

Listed in ZivaHub and Deakin Research Online — shown once because both records carry DOI 10.1021/jacs.6c05709.s001

Identifying the key parameters that govern magnetic ground states in complex intermetallics remains a central challenge in materials chemistry.

Description

Although the valence-electron concentration (<i>e</i>/<i>a</i>) has frequently been used to classify magnetism in Tsai-type approximant crystals, its predictive power is limited across different alloy families and constituent elements. Here, we demonstrate that the lattice parameter serves as a unified structural parameter governing magnetic ground state selection in Tsai-type icosahedral compounds.

Within the framework presented in this work, magnetic ground states collapse onto a single phase diagram that is independent of alloy family and rare-earth species: antiferromagnetic order emerges above a critical lattice parameter of ∼14.72 Å, whereas ferromagnetic order is stabilized within the intermediate range 14.62 Å ≲ <i>a</i> ≲ 14.72 Å. These results indicate that the lattice parameter serves as an experimentally accessible structural parameter that encodes the electronic information traditionally represented by <i>e</i>/<i>a</i> and thereby provides a unified description of magnetic ground state selection.

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The trends revealed in the present work provide a useful guideline for identifying compositions that may stabilize previously unexplored magnetic phases, including antiferromagnetic quasicrystals and hedgehog-like magnetic textures.

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Provenance · 2 source records, 23 field assertions
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ZivaHuboai:figshare.com:article/340299675 d agoJSON v1
Deakin Research Onlineoai:figshare.com:article/340299675 d agoJSON v1
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