deepmodeling / deepmodeling/deepks-kit
Pyscf version doesn't match DeePKS
- Dominant language
- Python
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Description
I want to try to reproduce this example, but after I submitted the execution command I got this error in the err file: TypeError: PenaltyMixin.get_fock() got an unexpected keyword argument ‘fock_last’, I asked the 'doubao' and the answer given is that the current pyscf library version is not compatible with the deepks library version, I also searched a lot of the github library you gave me but didn't find any result, so I would like to ask you what is the version of the pyscf library that the deepks library is adapted to?

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