Onetep Parser

This is the parser for Onetep. It is part of the NOMAD Laboratory. The official version lives at

git@gitlab.mpcdf.mpg.de:nomad-lab/parser-Onetep.git

you can browse it at

https://gitlab.mpcdf.mpg.de/nomad-lab/parser-Onetep

It relies on having the nomad-meta-info and the python common repositories one level higher. The simplest way to have this is to check out nomad-lab-base recursively:

git clone --recursive git@gitlab.mpcdf.mpg.de:nomad-lab/nomad-lab-base.git

then this will be in parsers/onetep.

TEST OUTPUT FILES

Few output files where to test the parser are provided in the directory test examples.

    FILE NAME     |              FILE DESCRIPTION
__________________|___________________________________________________
"single_point.out" --> Single Point Calculation (minimum verbosity)