orcabas retrieves basis sets supported by ORCA.
orcabas *.out
orcabas -h
After downloading the tarball and using cd to go where the files are, simply do a sudo make install and everything will be installed.
This repository has been archived by the owner on Jul 10, 2023. It is now read-only.
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🐰 Simple basis set parser for the ORCA quantum chemistry package
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schneiderfelipe/orcabas
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🐰 Simple basis set parser for the ORCA quantum chemistry package
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