pyscfad.df.df.DF.to_pyscf

DF.to_pyscf(nocopy_names=(), out=None)

Convert the pyscfad object to its pyscf counterpart.

The conversion effectively removes the tracing of the object and its members.

Parameters:

objobject

The pyscfad object to be converted.

nocopy_namestuple, default=()

Names of attributes that are not copied to the pyscf object.

outobject, optional

The target pyscf object.

Notes

Member arrays will be converted (whether a copy is made depends on the implementation of __array__ function) to numpy arrays.