Dear All, When performing noncollinear calculations with pw.x (qe_version=7.0) and interfacing with Wannier90, can the symmetries of the Wannier Hamiltonian be fitted? I tried to use the following parameters in pw2wannier90.x, but an error occurred: -----------------------------------input------------------------------------------- &inputpp outdir='./tmp' prefix='Co_gra', seedname = 'Co_gra' write_unk = .true. write_dmn = .true. ! Additional input for symmetry-adapted mode / ------------------------------output---------------------------------- Error in routine compute_dmn (1): Non-collinear not implemented ----------------------------------------------------------------------------------------- Are there any other approaches to fit the symmetries of the Wannier Hamiltonian? Best regards, Debo Hao Beijing Graphene Institute, China
_______________________________________________ Wannier mailing list [email protected] https://lists.quantum-espresso.org/mailman/listinfo/wannier
