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Fixed change of name for vasp input set generator.
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davidwaroquiers committed Sep 25, 2023
1 parent a576ea2 commit bdb0a99
Showing 1 changed file with 6 additions and 6 deletions.
12 changes: 6 additions & 6 deletions src/pycc4s/workflows/sets/vasp.py
Original file line number Diff line number Diff line change
Expand Up @@ -4,7 +4,7 @@
"""
from dataclasses import dataclass

from atomate2.vasp.sets.base import VaspInputSetGenerator
from atomate2.vasp.sets.base import VaspInputGenerator
from atomate2.vasp.sets.core import StaticSetGenerator
from pymatgen.core.structure import Structure
from pymatgen.io.vasp.outputs import Outcar, Vasprun
Expand Down Expand Up @@ -54,7 +54,7 @@ def get_incar_updates(


@dataclass
class NonSCFHFSetGenerator(VaspInputSetGenerator):
class NonSCFHFSetGenerator(VaspInputGenerator):
"""Class to generate VASP non-self-consistent field Hartree-Fock input sets."""

calc_type: str = "nonscf_hf"
Expand Down Expand Up @@ -110,7 +110,7 @@ def get_incar_updates(


@dataclass
class NonSCFMP2CBSSetGenerator(VaspInputSetGenerator):
class NonSCFMP2CBSSetGenerator(VaspInputGenerator):
"""Class to generate VASP non-self-consistent field Hartree-Fock input sets."""

calc_type: str = "nonscf_hf"
Expand Down Expand Up @@ -165,7 +165,7 @@ def get_incar_updates(


@dataclass
class NonSCFMP2NOsSetGenerator(VaspInputSetGenerator):
class NonSCFMP2NOsSetGenerator(VaspInputGenerator):
"""Class to generate VASP non-self-consistent field Hartree-Fock input sets."""

calc_type: str = "nonscf_hf"
Expand Down Expand Up @@ -220,7 +220,7 @@ def get_incar_updates(


@dataclass
class NonSCFHFNOsSetGenerator(VaspInputSetGenerator):
class NonSCFHFNOsSetGenerator(VaspInputGenerator):
"""Class to generate VASP non-self-consistent field Hartree-Fock input sets."""

calc_type: str = "nonscf_hf"
Expand Down Expand Up @@ -277,7 +277,7 @@ def get_incar_updates(


@dataclass
class VaspDumpCc4sFilesGenerator(VaspInputSetGenerator):
class VaspDumpCc4sFilesGenerator(VaspInputGenerator):
"""Class to generate input set for dumping cc4s files."""

calc_type: str = "vasp_cc4s_dump"
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