Name		Name	Last commit message	Last commit date
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test_files		test_files
.gitignore		.gitignore
README.md		README.md
normie.py		normie.py
orca2dict.py		orca2dict.py

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scripts4compchem

Collection of hacks/scripts that I use for computational chemistry calculations.

TODO:

General

documentation
testing

orca2json:

does not work properly for open shell systems

normie.py

some sort of cli interface

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