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    Origin of ferromagnetism and trends in Berry curvature driven anomalous Hall conductivity in the metallic rare-earth antimonides RCrSb3 (R = La, Ce, Nd)

    Arnab Paul1,*, Samir Rom1,*, Prabuddha Sanyal2, and Tanusri Saha Dasgupta1,†

    • *These authors contributed equally to this work.
    • †Contact author: t.sahadasgupta@gmail.com

    Phys. Rev. B 112, 094427 – Published 12 September, 2025

    DOI: https://doi.org/10.1103/vqb7-vz11

    Abstract

    Employing a combination of first-principles calculations and an ab initio derived model Hamiltonian study, we investigate the electronic and magnetic properties of the rare-earth antimonides LaCrSb3, CeCrSb3, and NdCrSb3. Our findings indicate that the long-range ferromagnetic order in these metallic compounds originates from a kinetic energy-driven double exchange mechanism, first proposed in the context of double perovskite compound Sr2FeMoO6. The calculated magnetic transition temperatures are in reasonable agreement with the measured values. The spin-orbit coupled band structure of the studied compounds reveals nontrivial topology, hosting multiple Weyl point crossings. The number of these crossings increases in moving from LaCrSb3 to CeCrSb3 to NdCrSb3, assisted by the lowering of the 5d states in nonzero f rare-earth compounds. The calculated anomalous Hall conductivity captures experimentally observed large anomalous Hall conductivity in these compounds, and the trend between LaCrSb3, CeCrSb3, and NdCrSb3. Our study provides a microscopic understanding of the trend.

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