naqs-for-quantum-chemistry
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20 hours ago •
tomdbar
tomdbar
Supporting code for "Autoregressive neural-network wavefunctions for ab initio quantum chemistry".
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Excellent code! I found KFACOptimizer implementation in src/optimizer/utils.py, but I met much problem changing the parameters to use it. Would you mind sharing how to use this optimizer?
Great code. It runs very smoothly and clearly outperforms the results in Choo et al. Would you consider re-engineering the code slightly to allow for a pipy installation?
