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first draft of README

Merged Hans Fangohr requested to merge adding-readme into main
+ 11
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@@ -150,7 +150,7 @@ The ``mpsd-software-manager`` python package.
- This needs a recent Python (3.9 or later).
- Install via pip or pipx.
Pipx commands are::
Pipx commands are:
- to install: ``pipx install git+https://gitlab.gwdg.de/mpsd-cs/mpsd-software-manager``
- to update: ``pipx upgrade mpsd-software-manager``
@@ -161,3 +161,13 @@ The ``mpsd-software-manager`` python package.
- Please check https://spack.readthedocs.io/en/latest/getting_started.html#system-prerequisites
The compilation of the ``*-mpi`` toolchains needs linux headers installed. (TODO Add more detail.)
Working example
~~~~~~~~~~~~~~~
We have a continuous integration example at XXX, that shows the complete
compilation cycle (including compilation of Octopus). (TODO)
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