[Wien] New installation of W2k

Mon May 25 07:40:18 CEST 2020

No, if you use the recommended scripts / procedure for initialization.

You did not write how you did the calculations, so we can't help.

w2web / command line ?  Which commands ....

Am 25.05.2020 um 05:57 schrieb Arthur H. Edwards:
> I am jsut running a test case with GaN in the zinc blend structure. dstart fails because the case.in1c and case.in2c files are missing. I'v hand copied case.in1_st and case.in2_st into the associated files, and was able to comp0lete3 the run_lapw. I'm just wondering whether I will always have to do this copying chore.
> 
> Thanks,
> 
> Art Edwards
> 

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Peter Blaha
Inst.Materials Chemistry
TU Vienna
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