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. 2020 Nov 13;11:5784. doi: 10.1038/s41467-020-19535-w

Fig. 4. Total internal energies of selected spin configurations for NiI2.

Fig. 4

a Total internal energies of triple-q states with topological charge ∣Q∣ = 2 and ∣Q∣ = 1 and of selected single-q states. All energies, given with respect to the lowest-energy A2Sk state in units of meV/spin, have been calculated for NiI2 using a 24 × 24 supercell with periodic boundary conditions. The superscript  ±  denotes the chiral partners of the given spin texture, related by a reflection with respect to the xy plane (and consistent with the sign of the off-diagonal terms stabilizing the given spin configuration, as discussed in the text). The single-q spin configurations have been generated by MC simulations artificially tuning the two-site anisotropy term. b Contributions to the total internal energy E1iso, E3iso, and Etwo-site aniso due to isotropic and anisotropic exchange interactions parametrized by J1iso, J3iso and Jtwo-site aniso, respectively, given with respect to the lowest-energy A2Sk state in units of meV/spin.