[Wien] lapw1.def failed

Lyudmila Dobysheva lyuka17 at mail.ru
Sat Dec 16 12:02:30 CET 2023


16.12.2023 10:37, shamik chakrabarti wrote:
> At the 7th cycle I got the following error;
>     stop error
> error: command   /home/akt/Desktop/Shamik_Installation/Wien2k/lapw1c 
> lapw1.def   failed
>  >   lapw1     -c (02:25:39) 737.008u 71.143s 5:39.69 237.9% 0+0k 
> 1064+165016io 8pf+0w
>  >   lapw0     (02:24:23) 176.006u 3.565s 1:16.19 235.6% 0+0k 
> 4264+103984io 22pf+0w
> In error file it is written as "Error in LAPW1"

Failed here not lapw1.def, but command lapw1c with a standard argument 
lapw1.def
You gave too little information. There should be some info, maybe in 
case.dayfile, or .output1, :log
Is it in parallel mode or not?
Try to repeat in terminal the command
x lapw1 -c
sometimes its output is more informative.
What are other settings? case.in* files?
Check what happened in the first six iterations and compare the outputs 
with those in the 7th.
Was computer well at that time? maybe some accident problem occurred? 
Does the stop repeat at the same place?
and so long, and so forth...

Best wishes
Lyudmila Dobysheva
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Russia
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