[Wien] SOC Error
Lyudmila Dobysheva
lyuka17 at mail.ru
Thu Oct 3 09:02:18 CEST 2019
> On 10/2/2019 7:26 AM, Paresh Rout wrote:
>> between SCF calculation (around 9th or 10th cycle) as below.
>> > lapw2 -up -p -c -so (13:21:14) running LAPW2 in parallel mode
>> ** LAPW2 crashed!
Look in the file case.scf2_XX, there can be some info like QTL-B VALUE,
:WARN at the end.
It is useful also to make this last wrong cycle in not-parallel mode,
then the diagnostic is a bit clearer.
Best wishes
Lyudmila Dobysheva
------------------
http://ftiudm.ru/content/view/25/103/lang,english/
Physics-Techn.Institute,
Udmurt Federal Research Center, Ural Br. of Rus.Ac.Sci.
426000 Izhevsk Kirov str. 132
Russia
---
Tel. +7 (34I2)43-24-59 (office), +7 (9I2)OI9-795O (home)
Skype: lyuka18 (office), lyuka17 (home)
E-mail: lyuka17 at mail.ru (office), lyuka17 at gmail.com (home)
More information about the Wien
mailing list