Re: [Wien] fold2Bloch installation problem.

It looks like there is probably something wrong with your file fold2Bloch.F90. In the compiler output, it looks like it found html tags like in fold2Bloch.F90. If you look at the fortran code [ https://github.com/rubel75/fold2Bloch/blob/master/fold2Bloch.F90 ], it does not look like it

[Wien] fold2Bloch installation problem.

Dear Wien2K users I am trying to compile fold2Bloch with the prescribed command line : ifort -warn all -traceback -free util.F fold2Bloch.F90 -o fold2Bloch but am getting errors which reads at the end like the following: -^ fold2Bloch.F90(1851):

Re: [Wien] case.klist_band for band structure calculation having R-3c spacegroup

You have to read the message from xcrysden more carefully: It says for this SG the "labelling" of k-points (Gamma - X- R - ...) is not supported. Otherwise it works, but you have to label the k-points yourself (eg. by comparison with the BZ displayd in the Bilbao crystallographic server).