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PreprintCC BY 4.0arXiv

Crystal symmetry predicts unconventional magnetism

Abstract

Unconventional compensated magnets combine zero net magnetization with momentum-dependent spin polarization, but identifying them usually requires knowledge of their magnetic order. Here we show that crystal symmetry can constrain unconventional magnetic character before the magnetic ground state is known. Starting from a non-magnetic crystal structure and a specified magnetic sublattice, we generate symmetry-compatible compensated orders and classify their spin textures using spin-space-group symmetry. We identify materials whose generated candidates are all unconventional, either across a defined search space or after restricting the magnetic-cell size. Within the experimental benchmark, 68% of the prioritized materials are unconventional, compared with 9% of the remaining materials. Screening the Materials Project yields thousands of promising candidates for unconventional compensated magnetism. First-principles calculations for VGe3 and tetragonal Fe2SiO4 connect these symmetry predictions to the energetics and spin textures of competing magnetic orders. In VGe3, a noncoplanar candidate permits mixed-wave spin polarization along a fixed axis without spin-orbit coupling, combining components that are odd and even under momentum reversal. This framework enables crystallography-guided searches for unconventional compensated magnets without first determining their magnetic ground states.

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BibTeX
@misc{song2026crystal,
  title = {{Crystal symmetry predicts unconventional magnetism}},
  author = {Ziyin Song and Zhong Fang and Chen Fang and Hongming Weng},
  howpublished = {arXiv},
  year = {2026},
  month = sep,
  doi = {10.48550/arxiv.2609.29989},
  eprint = {2609.29989},
  archivePrefix = {arXiv},
  url = {https://arxiv.org/abs/2609.29989},
  note = {CC BY 4.0},
}
RIS
TY  - UNPB
TI  - Crystal symmetry predicts unconventional magnetism
AU  - Ziyin Song
AU  - Zhong Fang
AU  - Chen Fang
AU  - Hongming Weng
PY  - 2026
DA  - 2026/09/24
PB  - arXiv
DO  - 10.48550/arxiv.2609.29989
UR  - https://arxiv.org/abs/2609.29989
AB  - Unconventional compensated magnets combine zero net magnetization with momentum-dependent spin polarization, but identifying them usually requires knowledge of their magnetic order. Here we show that crystal symmetry can constrain unconventional magnetic character before the magnetic ground state is known. Starting from a non-magnetic crystal structure and a specified magnetic sublattice, we generate symmetry-compatible compensated orders and classify their spin textures using spin-space-group symmetry. We identify materials whose generated candidates are all unconventional, either across a defined search space or after restricting the magnetic-cell size. Within the experimental benchmark, 68% of the prioritized materials are unconventional, compared with 9% of the remaining materials. Screening the Materials Project yields thousands of promising candidates for unconventional compensated magnetism. First-principles calculations for VGe_3 and tetragonal Fe_2SiO_4 connect these symmetry predictions to the energetics and spin textures of competing magnetic orders. In VGe_3, a noncoplanar candidate permits mixed-wave spin polarization along a fixed axis without spin-orbit coupling, combining components that are odd and even under momentum reversal. This framework enables crystallography-guided searches for unconventional compensated magnets without first determining their magnetic ground states.
ER  -