[Wien] error in dstart al2O3 example

Peter Blaha pblaha at zeus.theochem.tuwien.ac.at
Sun Aug 31 10:45:42 CEST 2003


> I am using the I looked at dstart error file, it says “can`t open unit 15. I wonder, if possible, example Al2O3 structure as in wien2k user manual, but it gives error on dstart. When could you please let me know, what is the problem.

When you have such an error, you should first look into  dstart.def.

Which file is connected with unit 15 ?

Now check with ls -als if you have this file and eventually look into it's
content.

My guess is you did not copy the temporaryly created *in* files to the
regular names, i.e. you missed one step in the initialization.

                                      P.Blaha
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Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
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