[Wien] Still problem with CLMSUM

[L. D. Marks]

You are not providing enough information
a) Recompile lapw0 with -tracebak
b) Look at the output, and find the relevant line in the code
c) Look at case.scf0, case.output0 etc
d) Look at case.clmsum

On Sat, 11 Mar 2006, Michael Gurnett wrote:

> Ran the new version of Wien2k. This occurs directly at the start of the
> second cycle. What is happening
>
>>>> (min) status after run_lapw -I -i 40 -fc 1.0 -p \: 9 -> exit
> lapw0              0000000000403E29  Unknown               Unknown  Unknown
> libc.so.6          000000351E01C3CF  Unknown               Unknown  Unknown
> lapw0              0000000000403EEA  Unknown               Unknown  Unknown
> lapw0              00000000004282A9  Unknown               Unknown  Unknown
> lapw0              0000000000481664  Unknown               Unknown  Unknown
> lapw0              00000000004709CC  Unknown               Unknown  Unknown
> lapw0              0000000000470D63  Unknown               Unknown  Unknown
> lapw0              000000000049930C  Unknown               Unknown  Unknown
> lapw0              00000000004B52DE  Unknown               Unknown  Unknown
> lapw0              00000000004B757B  Unknown               Unknown  Unknown
> Image              PC                Routine            Line        Source
> forrtl: severe (64): input conversion error, unit 8, file /home/Michael/Wien2k/HCT-Lisqrt3/HCT-Lisqrt3.clmsum
> in cycle 2    ETEST: 84.5785025000000000   CTEST: .3760374
> ec cc and fc_conv 1 1 0
>
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Note: if you have an old email address for me, please note that "nwu" has
been changed to "northwestern".
-----------------------------------------------
Laurence Marks
Department of Materials Science and Engineering
MSE Rm 2036 Cook Hall
2220 N Campus Drive
Northwestern University
Evanston, IL 60201, USA
Tel: (847) 491-3996 Fax: (847) 491-7820
email: L-marks at northwestern dot edu
http://www.numis.northwestern.edu
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