graphcore-research / pyscf-ipu

PySCF on IPU
https://github.com/graphcore-research/pyscf-ipu#readme
Apache License 2.0
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Add derivation for binom_factor #120

Open hatemhelal opened 9 months ago

hatemhelal commented 9 months ago

The linked reference in the binom_factor documentation string is not widely accessible. This particular result should be derived in a notebook to make the implementation easier to follow.

see: https://github.com/graphcore-research/pyscf-ipu/blob/023e11487762731117d73d14bc98b2f74226f800/pyscf_ipu/experimental/special.py#L99-L105