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fix lint
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QuantumChemist committed Jan 25, 2025
1 parent 0e8d187 commit 6492d96
Showing 1 changed file with 5 additions and 3 deletions.
8 changes: 5 additions & 3 deletions src/atomate2/vasp/flows/lobster.py
Original file line number Diff line number Diff line change
Expand Up @@ -8,6 +8,7 @@
from jobflow import Flow, Maker
from monty.dev import requires

from atomate2.forcefields.jobs import ForceFieldRelaxMaker
from atomate2.lobster.jobs import LobsterMaker
from atomate2.vasp.flows.core import DoubleRelaxMaker, UniformBandStructureMaker
from atomate2.vasp.jobs.core import NonSCFMaker, RelaxMaker, StaticMaker
Expand All @@ -18,7 +19,6 @@
update_user_incar_settings_maker,
)
from atomate2.vasp.sets.core import NonSCFSetGenerator, StaticSetGenerator
from atomate2.forcefields.jobs import ForceFieldRelaxMaker

try:
import ijson
Expand All @@ -31,7 +31,9 @@

if TYPE_CHECKING:
from pathlib import Path

from pymatgen.core import Structure

from atomate2.vasp.jobs.base import BaseVaspMaker


Expand Down Expand Up @@ -185,7 +187,7 @@ def make(
jobs.append(delete_wavecars)

return Flow(jobs, output=lobster_jobs.output)


@dataclass
class MlffVaspLobsterMaker(VaspLobsterMaker):
Expand All @@ -207,7 +209,7 @@ class MlffVaspLobsterMaker(VaspLobsterMaker):
name : str
Name of the flows produced by this maker.
relax_maker : .ForceFieldRelaxMaker
A MLFF based maker to perform a relaxation on the bulk.
A MLFF based maker to perform a relaxation on the bulk.
lobster_static_maker : .BaseVaspMaker
A maker to perform the computation of the wavefunction before the static run.
Cannot be skipped. It can be LOBSTERUNIFORM or LobsterStaticMaker()
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