How to cite

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Reliability and applicability of magnetic-force linear response theory: Numerical parameters, predictability, and orbital resolution

H. Yoon, T. J. Kim, J.-H. Sim, S. W. Jang, T. Ozaki, and M. J. Han, Phys. Rev. B 97, 125132 (2018).

In this paper, we examined spin exchange interaction J on classical magnetic metal, insulator systems by MFT. Extensive tests were performed on numerical parameter dependences such as basis orbital set, LDA + U parameter. Also, comparisons were made between MFT based on meta-stable spin configurations, and expansion to orbital-resolved magnetic interactions are presented.

Jx: An open-source software for calculating magnetic interactions based on magnetic force theory.

H. Yoon, T. J. Kim, J.-H. Sim, and M. J. Han, Computer Physics Communications 247, 106927 (2020).

The Opensource Jx code paper. In this paper, we presented why our code is user-friendly and also efficient tool to calculate magnetic interaction in solids and molecules. We also describe the advantages of computing short- and long-range interactions in one-shot and capability of computing orbital-resolved matrices, local axis rotation.

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List of papers used Jx

For users to share informations, please inform us your paper in which Jx have made meaningful contribution to the study.

1. Reliability and applicability of magnetic-force linear response theory: Numerical parameters, predictability, and orbital resolution
   • H. Yoon, T. J. Kim, J.-H. Sim, S. W. Jang, T. Ozaki, and M. J. Han, Phys. Rev. B 97, 125132 (2018).
2. Calculating magnetic interactions in organic electrides
   • T. J. Kim, H. Yoon, and M. J. Han, Phys. Rev. B 97, 214431 (2018).
3. Charge density functional plus U theory of LaMnO3: Phase diagram, electronic structure, and magnetic interaction
   • S. W. Jang, S. Ryee, H. Yoon, and M. J. Han, Phys. Rev. B 98, 125126 (2018).
4. Microscopic understanding of magnetic interactions in bilayer CrI3
   • S. W. Jang, M. Y. Jeong, H. Yoon, S. Ryee, and M. J. Han, Phys. Rev. Materials 3, 031001 (2019).
5. Magnetic force theory combined with quasi-particle self-consistent GW method
   • H. Yoon, S. W. Jang, J.-H. Sim, T. Kotani, and M. J. Han, Journal of Physics: Condensed Matter 31, 405503 (2019)
6. On the origin and the manipulation of ferromagnetism in Fe3GeTe2: defects and dopings
   • S. W. Jang, M. Y. Jeong, H. Yoon, S. Ryee, and M. J. Han, ArXiv:1904.04510 [Cond-Mat] (2019).
7. Jx: An open-source software for calculating magnetic interactions based on magnetic force theory.
   • H. Yoon, T. J. Kim, J.-H. Sim, and M. J. Han, Computer Physics Communications 247, 106927 (2020).
8. Induced magnetic two-dimensionality by hole doping in the superconducting infinite-layer nickelate Nd1−xSrxNiO2
   • S. Ryee, H. Yoon, T. J. Kim, M. Y. Jeong, and M. J. Han, Phys. Rev. B 101, 064513 (2020).
9. Switching interlayer magnetic order in bilayer CrI3 by stacking reversal
   • X. Kong, H. Yoon, M. J. Han, L. Liang, Nanoscale, 13, 16172-16181 (2021)
10. Hund’s physics and the magnetic ground state of CrOX (X=Cl,Br)
    • S. W. Jang, D. H. Kiem, J. Lee, Y.-G. Kang, H. Yoon, and M. J. Han, Phys. Rev. Materials 5, 034409 (2021)
11. Strain engineering and the hidden role of magnetism in monolayer VTe2
    • D. H. Kiem, M. Y. Jeong, H. Yoon, and M. J. Han, Nanoscale (Communication), 14, 10009-10015 (2022)
12. Ab Initio Spin Hamiltonian and Topological Noncentrosymmetric Magnetism in Twisted Bilayer CrI3
    • K.-M. Kim, D. H. Kiem, G. Bednik, M. J. Han, and M. J. Park, Nano Lett. 23, 13, 6088-6094 (2023)