Python UKS Examples

Example #1

 def x2c1e(self):
     from pyscf.x2c import x2c
     x2chf = x2c.UKS(self.mol)
     x2c_keys = x2chf._keys
     x2chf.__dict__.update(self.__dict__)
     x2chf._keys = self._keys.union(x2c_keys)
     return x2chf

Example #2

def UKS(mol, *args):
    return x2c.UKS(mol, *args)