[Wien] trouble with clmcopy.def

tasaka at affinity-science.com tasaka at affinity-science.com
Thu Nov 8 03:35:56 CET 2012


Hello,

I found that clmcopy can't work well in version 12.1.
it's because of clmcopy.def. so, please modify/update x_lapw as below.

tasaka at theta:~/work/tmp/SRC$ diff x_lapw x_lapw.new 
1688,1689c1688,1689
<   echo "17,'$file.vresp$ending$updn',     'old',    'formatted',  0"
<   echo "18,'$file.vresp$ending$dnup',     'unknown','formatted',  0"
---
>   echo "17,'$file.vresp$ending$updn',     'old',    'formatted',  0">>$def
>   echo "18,'$file.vresp$ending$dnup',     'unknown','formatted',  0">>$def
1691,1692c1691,1692
<   echo "17,'$file.clm$ending$updn',     'old',    'formatted',  0"
<   echo "18,'$file.clm$ending$dnup',     'unknown','formatted',  0"
---
>   echo "17,'$file.clm$ending$updn',     'old',    'formatted',  0">>$def
>   echo "18,'$file.clm$ending$dnup',     'unknown','formatted',  0">>$def
tasaka at theta:~/work/tmp/SRC$ 


With best regards,
Tomo





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