[Wien] PGI

[Peter Blaha]

> Newest version of PGI compiler gives a runtime "data conversion error"
> in nn.f (line 95).
> Does anyone know a workaround?

This concerns this read:

      READ(20,1511) LATTIC,NAT,title


Are you sure your struct file is correct? (100-atom fix ?)

Put a ERR=xxx label and print whatever it could read.

                                      P.Blaha
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Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-1-58801-15671             FAX: +43-1-58801-15698
Email: blaha at theochem.tuwien.ac.at    WWW: http://info.tuwien.ac.at/theochem/
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