• Gregor Michalicek's avatar
    Fixed erroneous generation of additional identity symmetry matrices · d78dba2b
    Gregor Michalicek authored
    Time reversal symmetry is exploited to increase the number of symmetry
    operations used for the generation of the Brillouin zone iff no inversion
    symmetry is present. So far the inverse of each symmetry operation was
    added, ignoring translation vectors. However, this could lead to further
    identity symmetry operations which caused problems as this matrix has
    to be excluded for several code parts.
    The fix was developed in collaboration with D. Wortmann.
julia.f90 15.3 KB