z2pack problem related to overlap matrices

潘祈叡 hawkingeric at gmail.com
Fri Aug 18 05:22:06 CEST 2017


Hi,

Thank you for sharing the z2pack! I'm writing this because I have
encountered a problem when I would like to reproduce the Be examples.

I have prepared the wannier90 input files in the directory named input and
INCAR, CHGCAR, POSCAR. When I use ./ex_Bi.py, there is error message as
attached in the Bi_err file.
(ex_Bi.py is from the example page of z2pack website)

The attached file contains the wannier90 input and all the vasp input.
Could you help me fix the problem?
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