[Wien] Deviation of elastic constants from reference values
Lyudmila Dobysheva
lyuka17 at mail.ru
Tue Jan 13 07:15:16 CET 2015
On 13.01.2015 09:14, Muhammad Sajjad wrote:
> Thank you for guidance. before I was running ./*eos.job
> ./*rhomb.job and ./*tetra.job.
> Now I should run simply "runsp_lapw".
No.
> On Tue, Jan 13, 2015 at 1:00 AM, Peter Blaha wrote:
> You have to edit the scripts eos.job ... (last line in your
> instructions) and select runsp_lapw instead of run_lapw
Edit eos.job, tetra.job and rhomb.job :
select runsp_lapw instead of run_lapw
Best wishes
Lyudmila Dobysheva
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