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Unconventional Thermal Expansion in quasi-one-dimensional monoclinic BaIrO$_3$

Materials Science 2025-11-07 v1

Abstract

We have investigated the temperature dependence of the crystal structure of quasi-one-dimensional monoclinic BaIrO3_3 using X-ray diffraction. Diffraction patterns were measured across a temperature range from 13 K to 300 K, with 5-degree steps, and Rietveld refinements were performed to extract the relevant lattice parameters. The resulting cell volumes exhibit a significant deviation from the Debye model predictions for lattice-specific heat within a reasonable range of the Debye temperature, Gr{\"u}neisen parameter, and bulk modulus. This suggests an invar-like, unconventional thermal expansion behavior. The deviation begins near the weak ferromagnetic transition temperature, indicating a strong correlation with changes in the electronic and magnetic structure of monoclinic BaIrO3_3.

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Cite

@article{arxiv.2511.04149,
  title  = {Unconventional Thermal Expansion in quasi-one-dimensional monoclinic BaIrO$_3$},
  author = {Jeong Jinwon and Chang Bin and Noh Han-Jin and Lee Seongsu},
  journal= {arXiv preprint arXiv:2511.04149},
  year   = {2025}
}

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6 figures