Dear Ph.
I have created MgB2.Strauct several times and try to run them before deleting
other files(while still other creations exist). Now although I have deleted all
of them and just remain one in the name of MgB2-1, after performing
initial.calc, during run-scf, this message is appeared: Error, Bad Header.
I know that this program doesn't recognize different routes pertinent to
special structure and I out to chosen just one correct route for it.
Please guide me how to abolish previous wrong routes.
Thanking you in anticipation.
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