[Wien] (no subject)

[Gerhard Fecher]

Seems not to be even close to the latest Version of Wien2k or did I miss an anouncement of Peter

More funny: "What is the question ?"

Ciao
Gerhard

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Dr. Gerhard H. Fecher
Institut of Inorganic and Analytical Chemistry
Johannes Gutenberg - University
55099 Mainz
________________________________________
Von: wien-bounces at zeus.theochem.tuwien.ac.at [wien-bounces at zeus.theochem.tuwien.ac.at] im Auftrag von Hajari Nejatii [hajar.nejatipoor at yahoo.com]
Gesendet: Sonntag, 7. Februar 2010 07:30
An: Wien at zeus.theochem.tuwien.ac.at
Betreff: [Wien] (no subject)

I am running wien version 95 of wien2k.
The purpose of my calculations is to get quantity lattice parameter 0f pyrite CH2(u-0.15).
I am running this case (pyrite.struct) using this input :RKmax=6.5 , Gmax=26.0(in initialize)
because with greater RKmax,I should have Gmax greater than 26.0 .
I read usersguide and FAQ page, but I couldent solve my problem.