[Wien] Error in SCF Calculation

hüsnü kara husnukara34 at gmail.com
Tue Aug 19 11:39:16 CEST 2014


Dear Wien Users,

I got StructGen and Initialization for SrTiO3 in spin-polarized case.

After that I got SCF scycle, it worked. Then I ran initso_lapw command
in a terminal.

Then I ran another SCF Scycle which contains initso_lapw. And I got this error:


forrtl: severe (174): SIGSEGV, segmentation fault occurred
Image              PC                Routine            Line
Source
libifcore.so.5     00002AAAAC9BD1F8  Unknown               Unknown  Unknown
libifcore.so.5     00002AAAAC9E58F8  Unknown               Unknown  Unknown
libifcore.so.5     00002AAAACA12CFC  Unknown               Unknown  Unknown
libifcore.so.5     00002AAAACA108AA  Unknown               Unknown  Unknown
lapw0              0000000000444DA5  MAIN__                    885  lapw0.F
lapw0              0000000000401D7C  Unknown               Unknown  Unknown
libc.so.6          0000003B17821A05  Unknown               Unknown  Unknown
lapw0              0000000000401C79  Unknown               Unknown  Unknown

>   stop error


Could you tell me about where did I do a mistake?

Best regards,
-- 

Hüsnü Kara
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