Dear QE developers:
When I calculate the pdos using projwfc.x, I get the following results in
prefix.pdos_tot
---------------------------------------------------------
# ik
E (eV) dosup(E) dosdw(E) pdosup(E) pdosdw(E)
1
-56.130 0.206E-02 0.206E-02 0.206E-02 0.206E-02
1
---------------------------------------------------------
I found the following format control lines in partialdos.90, like line 166:
---------------------------------------------------------
WRITE (4,'("# ik "), advance="NO"')
---------------------------------------------------------
When the code is compiled, the compiler told me:
---------------------------------------------------------
partialdos.f90(166): warning #8043: The extra characters in the format
specification will be ignored. ['("# ik "), advance="NO"']
WRITE (4,'("# ik "), advance="NO"')
--------------------------------^
---------------------------------------------------------
So It seems that the ' is placed in the incorrect position.
When it is modifiled as:
---------------------------------------------------------
WRITE (4,'("# ik ")', advance="NO")
---------------------------------------------------------
The output prefix.pdos_tot seems correct:
---------------------------------------------------------
# ik E (eV) dosup(E) dosdw(E) pdosup(E) pdosdw(E)
1 -56.130 0.206E-02 0.206E-02 0.206E-02 0.206E-02
---------------------------------------------------------
What I use:
QE version: 5.2.1
Fortran compiler: Intel composer_xe_2015
Thanks for providing the QE package.
Regards
Shujun Hu_______________________________________________
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