[Pw_forum] PWSCF and PAW
Chao Cao
cao at qtp.ufl.edu
Fri Mar 2 20:55:03 CET 2007
Dear PWSCF users,
Since I see there's a subdirectory in atomic_doc/ about PAW
pseudopotential generation, and also several files about PAW in
directory PW/, I assumed that PWSCF is capable to use PAW
pseudopotentials. However, when I set the pseudopotential to the file
produced in paw_gen_test/, the program fails because of "pseudopotential
is empty or wrong". So, does that mean I can't use PAW or I have to turn
on some secrete flags in the input file? Thanks
Best
Chao Cao
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