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General scripts for everyday use
C++ Python Fortran Other
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analyse
build Create radial_cutout.py Feb 13, 2020
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AUTHORS.md
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README.md
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README.md

Software

General scripts and software for everyday computational chemistry. Folder names are designed to be self explanatory but just in case we have:

build - contains scripts to build stuff

run - contains example runtime scripts

analyse - contains scripts for post-processing

If you want to contribute, great! Here are excellent resources on:

Be sure to also add your name to the AUTHORS file so you get the credit deserved.

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