[Wien] (no subject)

Lyudmila Dobysheva lyuka17 at mail.ru
Sat Mar 23 11:20:25 CET 2013


23.03.2013 13:35, Ghazal Bishal пишет:
> /root/WIEN2k/CaMnO3/spin-orb/CaMnO3/CaMnO3.in2c
> forrtl: severe (64): input conversion error, unit 5, file
> /root/WIEN2k/CaMnO3/spin-orb/CaMnO3/CaMnO3.in2c
> LAPWSO END

Dear Ghazal,

In both cases it says that your input file CaMnO3.in2c is incorrect. 
Maybe it was wrongly constructed during the initialization procedure, or 
during initso procedure struct file was changed (number of atoms has 
been changed) and the file in2c was not changed in accord.
So, you should repeat the initialization procedure and pay attention to 
this. If no use, send the struct and in2c files.

Best regards
   Lyudmila Dobysheva
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