Compatibility of DFT+U with non-collinear magnetism and spin-orbit coupling within a framework of numerical atomic orbitals.
Fernando Gómez-OrtizNayara Carral-SainzJames SifunaVirginia MonteseguroRamón CuadradoPablo García-FernándezJavier JunqueraPublished in: Comput. Phys. Commun. (2023)