[Wien] using of Wien functions such as x spectra or elnes spectra

[Peter Blaha]

> Certain programs seem do not work at all, or produce errors ... I can not calculate x (absorption or emission) spectra because the txspec does not work, even if the calculations seems to be good ... How to proceed ?

Certain users don't know how to use these programs. Other's can.

If you do not provide more info, definitely nobody can help you.

                                      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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