[Wien] run init_so_lapw non-interactively

[Mikhail Nestoklon]

Dear Long,
There is always a workaround:
$ EDITOR2=$EDITOR
$ export EDITOR=cat
$ echo -ne "\n\n\n\n\n" | init_so_lapw
$ export EDITOR=$EDITOR2

You may put desired input in echo command, or use sed to change
case.inso in a more complex way. E.g.,  use 'sed -i "2s/^.\{2\}/ 6/"
${PWD##*/}.inso' (in bash, for csh ${PWD##*/} may fail) to change llmax in
inso file, etc.

Best,
M.


On Wed, 18 Jun 2025 at 09:28, Long Zhang via Wien <
wien at zeus.theochem.tuwien.ac.at> wrote:

> Dear WIEN2k users,
>
> Is there a way to run init_so_lapw in batch mode like the init_lapw?
> I am trying to scan a group of structures, all with SOC. Doing
> init_so_lapw one by one interactively would be too tedious.
>
> Thanks,
> Long
>
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