[Wien] Problem_elastic constants calculations

Debojyoti Mukherjee debojyoti.kunal at gmail.com
Tue Sep 18 09:05:08 CEST 2012


Dear Wien users and Dr. Jamal,

I was trying to calculate the elastic constants of tetragonal alpha- Pt2Si
using the code developed by Dr. M. Jamal. Unfortunately, in two different
computers I got two different problems regarding this.

1. One computer says:

Too many ('s. when I gave the command  T_calljob_lapw.

2. Computer 2 says:

T_setupc1112: Command not found.
chmod: cannot access 'TETRA.job': No such file or directory.....etc when
T_set_elast_lapw command was given.


Did I make any mistake in compilation of the code. Any help would be very
much appreciated.


D. Mukherjee


-- 
Scientific Officer - D,
Applied Physics Division,
Bhabha Atomic Research Center,
Mumbai - 400085,
India.
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