.as_dict() method on VaspInput causes an AttributeError

[Andrew-S-Rosen]

Python version

3.11

Pymatgen version

2024.5.1

Operating system version

No response

Current behavior

When calling VaspInputSet.get_input_set(), the returned VaspInput has a broken .as_dict() method. That is reported below. The returned VaspInput is already a dict, so that's what should be presented. What is somewhat confusing though is that the method should really be called .get_vasp_input() since it returns a VaspInput and not a VaspInputSet.

from pymatgen.core import Structure
from pymatgen.io.vasp.sets import MPStaticSet

s = Structure(
    lattice=[[0, 2.13, 2.13], [2.13, 0, 2.13], [2.13, 2.13, 0]],
    species=["Ni", "O"],
    coords=[[0, 0, 0], [0.5, 0.5, 0.5]],
)
vasp_input = MPStaticSet().get_input_set(structure=s, potcar_spec=True)
print(vasp_input.as_dict())

Traceback:

File ~/software/miniconda/envs/quacc/lib/python3.11/site-packages/pymatgen/io/vasp/inputs.py:2758, in VaspInput.as_dict(self)
   2756 def as_dict(self) -> dict:
   2757     """MSONable dict."""
-> 2758     dct = {key: val.as_dict() for key, val in self.items()}
   2759     dct["@module"] = type(self).__module__
   2760     dct["@class"] = type(self).__name__

File ~/software/miniconda/envs/quacc/lib/python3.11/site-packages/pymatgen/io/vasp/inputs.py:2758, in <dictcomp>(.0)
   2756 def as_dict(self) -> dict:
   2757     """MSONable dict."""
-> 2758     dct = {key: val.as_dict() for key, val in self.items()}
   2759     dct["@module"] = type(self).__module__
   2760     dct["@class"] = type(self).__name__

AttributeError: 'list' object has no attribute 'as_dict'

Expected Behavior

The .as_dict() method should return a dictionary.