Hello there,
Does anybody aware of these observations for the latest version 2.6.2 or just my case:
When I examine the WT.out file I found strange values of lattice vectors for rotated-unit cell, i.e. after line "The lattice vectors for new cell are :" and line: "The rotated new unit cell in cartesian coordinates :" even though everything else including the generated POSCAR for SURFACE and slab looks correct.
Another minor issue is the range of k-value for plotting surface band structure (slabek.gnu) is just half of what is designated in wt.in; this problem does not appear in the plotting files for surface state spectrum (surfdos_l.gnu or surfdos_r.gnu) though.
Thanks!
Hello there, Does anybody aware of these observations for the latest version 2.6.2 or just my case: When I examine the WT.out file I found strange values of lattice vectors for rotated-unit cell, i.e. after line "The lattice vectors for new cell are :" and line: "The rotated new unit cell in cartesian coordinates :" even though everything else including the generated POSCAR for SURFACE and slab looks correct. Another minor issue is the range of k-value for plotting surface band structure (slabek.gnu) is just half of what is designated in wt.in; this problem does not appear in the plotting files for surface state spectrum (surfdos_l.gnu or surfdos_r.gnu) though. Thanks!