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qp2/src/basis
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Anthony Scemama b5da98c415 Add ao_first_of_shell for trexio
2021-10-12 16:01:16 +02:00
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basis.irp.f Normalization in basis 2021-06-01 19:46:15 +02:00
EZFIO.cfg Add ao_first_of_shell for trexio 2021-10-12 16:01:16 +02:00
NEED Changed Symmetry into Angmom in OCaml 2021-05-21 16:42:48 +02:00
README.rst Changed Symmetry into Angmom in OCaml 2021-05-21 16:42:48 +02:00

README.rst 

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basis
======

This module contains the basis set information, which will then be used to build the atomic orbitals.