[Wien] dstart error

Lyudmila Dobysheva lyuka17 at mail.ru
Tue Jun 4 11:10:55 CEST 2013


04.06.2013 10:25, vishal jain wrote:
> I make a surface Fe(100) using Structgen, During the initilization its
> shows following error
> DSTART - Error
   'DSTART' - can't open unit: 15
  'DSTART' -        filename: Fe1.in2c

Dear Vishal Jain,

I see that both struct files attached have inversion symmetry but the 
error is about in2c file. Maybe there occasionally appeared the 
complex-calculation mark in w2web?
So, make the calculation with inversion: remove this mark if it exists
in w2web, and "change session information"

Best regards
   Lyudmila Dobysheva
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