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Fix import
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JosePizarro3 committed Oct 10, 2024
1 parent 3ad832d commit 1fb5864
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Showing 3 changed files with 2 additions and 4 deletions.
2 changes: 1 addition & 1 deletion pyproject.toml
Original file line number Diff line number Diff line change
Expand Up @@ -27,7 +27,7 @@ maintainers = [
license = { file = "LICENSE" }
dependencies = [
"nomad-lab@git+https://gitlab.mpcdf.mpg.de/nomad-lab/nomad-FAIR.git@6b7149a71b2999abbb2225fcb67a5acafc811806",
"nomad-simulations@git+https://github.com/nomad-coe/nomad-simulations.git@0732ea7c9d4c5afcc8b01e3dbfd9235cfc7ffe4c",
"nomad-simulations@git+https://github.com/nomad-coe/nomad-simulations.git@447535db40f81006ece2cea2b59b9ac7e4ac8c6f",
]

[project.urls]
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1 change: 0 additions & 1 deletion src/nomad_parser_wannier90/parsers/parser.py
Original file line number Diff line number Diff line change
Expand Up @@ -574,7 +574,6 @@ def parse(
dft_plus_tb_archive = self._child_archives.get(
'DFTPlusTB_workflow'
)
print(dft_archive, self.archive)
dft_plus_tb = parse_dft_plus_tb_workflow(
dft_archive=dft_archive, tb_archive=self.archive
)
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3 changes: 1 addition & 2 deletions src/nomad_parser_wannier90/parsers/utils/utils.py
Original file line number Diff line number Diff line change
Expand Up @@ -6,7 +6,7 @@
import os
from glob import glob

from nomad.datamodel.metainfo.workflow_new import TaskReference
from nomad.datamodel.metainfo.workflow_new import TaskReference2 as TaskReference
from nomad_simulations.schema_packages.workflow import DFTPlusTB


Expand Down Expand Up @@ -57,7 +57,6 @@ def parse_dft_plus_tb_workflow(

if not dft_archive.workflow2 or not tb_archive.workflow2:
return
print(dft_archive.workflow2, tb_archive.workflow2)

dft_task = dft_archive.workflow2
tb_task = tb_archive.workflow2
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