[Wien] What difference between case.outputt and case.dos

[Stefaan Cottenier]

>
>
> Part of difference in file:
>
>   case.outputtup             case.dos1up
>
>   0.64200   170.01           0.64200  138.39558411
>
>   0.64400    99.10           0.64400  100.02245331
>
>   0.64600    37.37           0.64600   53.89491653
>
>   0.64800    16.70           0.64800   27.42510796
>
>   0.65000    17.44           0.65000   20.72312164
>
>   0.65200    23.74           0.65200   22.59245491
>
> (...)
>
>   0.67600    42.55           0.67600   44.05356216
>
>   0.67800     3.78           0.67800   17.01902580
>
>   0.68000     0.00           0.68000    3.61297321
>
>   0.68200     0.00           0.68200    0.39261794
>
>   0.68400     0.00           0.68400    0.52523547
>
>   0.68600     0.00           0.68600    6.47881126
>
>   0.68800     0.00           0.68800   31.39921761
>
>   0.69000   114.73           0.69000   63.56669998
>
>  
>
Allthough the differences look large, I bet you will hardly see them on 
a plot. It looks like in one of the cases smearing is applied, and in 
the other not? Try with smearing zero, could be that in that case they 
are the same. If smearing is really the origin, then this might be a 
small programming inconsistency!?

Stefaan


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