[Wien] (no subject)

[Laurence Marks]

Bad structure of inorb, read the UG carefully.

2011/8/8 ahmed amine <ahmedamine_dz at hotmail.fr>:
> hello
>
> when i run GGA+u (WC-GGA) i found this error
>
> linux-hycq:~/case # runsp_lapw -orb
>  LAPW0 END
>  LAPW1 END
>  LAPW1 END
>  LAPW2 END
>  LAPW2 END
> LAPWDM END
> LAPWDM END
>  CORE  END
>  CORE  END
>  MIXER END
> in cycle 2    ETEST: 0   CTEST: 0
>  LAPW0 END
> forrtl: severe (64): input conversion error, unit 5, file
> /root/case/case.inorb
> Image              PC                Routine            Line
> Source
> orb                00000000004A615D  Unknown               Unknown  Unknown
> orb                00000000004A4C65  Unknown               Unknown  Unknown
> orb                0000000000452060  Unknown               Unknown  Unknown
> orb                000000000041BDBF  Unknown               Unknown  Unknown
> orb                000000000041B5F2  Unknown               Unknown  Unknown
> orb                0000000000438ADB  Unknown               Unknown  Unknown
> orb                0000000000409D71  init_                      70  init.f
> orb                0000000000403949  MAIN__                    103  main.f
> orb                000000000040336C  Unknown               Unknown  Unknown
> libc.so.6          00002B16D2C96B7D  Unknown               Unknown  Unknown
> orb                0000000000403269  Unknown               Unknown  Unknown
>
>>   stop error
>
>
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-- 
Laurence Marks
Department of Materials Science and Engineering
MSE Rm 2036 Cook Hall
2220 N Campus Drive
Northwestern University
Evanston, IL 60208, USA
Tel: (847) 491-3996 Fax: (847) 491-7820
email: L-marks at northwestern dot edu
Web: www.numis.northwestern.edu
Chair, Commission on Electron Crystallography of IUCR
www.numis.northwestern.edu/
Research is to see what everybody else has seen, and to think what
nobody else has thought
Albert Szent-Gyorgi