Closed Gargee-123 closed 2 years ago
Dear @Gargee-123
Just as a try: if you change encoding='UTF-8'
to encoding='latin-1'
will the problem be solved for you?
If not, show the new error message
Dear Stepan,
I will check that and let you know about it.
Dear BandUP Developers,
I am getting one error while generating SC k-path. Please help me to solve this problem. I have attached here the inputs.
step_2_get_kpts_to_be_used_in_the_SC_band_struc_calcs.zip
Thanks & regards Gargee
**=========================================================================== BandUP: Band Unfolding code for Plane-wave based calculations
v3.0.0-beta.6-9-gbd3ff1f, 2021-04-13 18:34:21 +0200 From Git branch: "master" Compiled using Intel Fortran (ifort) V1910 on Thu Nov 04 10:39:07 2021
Copyright (C) 2013-2017 Paulo V. C. Medeiros
Please visit www.ifm.liu.se/theomod/compphys/band-unfolding
Checking if you are working with the smallest possible SC:
OK!
Checking if working with the smallest possible ref. unit cell: