Try it out.
Am 02.06.2023 um 14:21 schrieb shamik chakrabarti:
Dear Wien2k users,
Initially I have forgotten to add -hf in a
calculation initialized for running -hf for one cycle. However, I have
stopped the calculation after one cycle which contains initialization of
-hf which produces lapw0 -grr during one iteration. After that I have
run clean_lapw & then start with the attached -hf flag. My query is
whether clean_lapw ensures that I do not have any error for continuing
with -hf or I may need to start a fresh calculation in a fresh directory?
Looking forward to hearing from you.
with regards,
--
Dr. Shamik Chakrabarti
Research Fellow
Department of Physics
Indian Institute of Technology Patna
Bihta-801103
Patna
Bihar, India
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