Fix import

FAIRmat-NFDI · Oct 10, 2024 · ced437d · ced437d · github-actions · Oct 10, 2024
1 parent 3ad832d
commit ced437d
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Showing 3 changed files with 2 additions and 4 deletions.
diff --git a/pyproject.toml b/pyproject.toml
@@ -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@7f4648808708d60d97bc3c29c566e04a1f63f7f1",
 ]
 
 [project.urls]

diff --git a/src/nomad_parser_wannier90/parsers/parser.py b/src/nomad_parser_wannier90/parsers/parser.py
@@ -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
                         )

diff --git a/src/nomad_parser_wannier90/parsers/utils/utils.py b/src/nomad_parser_wannier90/parsers/utils/utils.py
@@ -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
 
 
@@ -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
File	Stmts	Miss	Cover	Missing
src/nomad_parser_wannier90
__init__.py	4	2	50%	3–4
_version.py	11	2	82%	5–6
src/nomad_parser_wannier90/parsers
__init__.py	10	2	80%	24–26
band_parser.py	51	15	71%	4, 24, 50–51, 73–74, 77–78, 85–89, 98–99, 104–105
dos_parser.py	18	1	94%	13
hr_parser.py	48	9	81%	4, 28, 46–47, 59–60, 94–96
parser.py	215	30	86%	8–9, 208, 262–263, 303, 360–361, 378, 395, 412, 468–471, 501, 533–581
win_parser.py	108	20	81%	5, 35–36, 65, 162, 169–171, 210, 221–222, 252–255, 262, 264–265, 269, 286–290
src/nomad_parser_wannier90/parsers/utils
utils.py	27	11	59%	4, 35–37, 56–74
src/nomad_parser_wannier90/schema_packages
__init__.py	8	2	75%	9–11
package.py	5	5	0%	1–11
TOTAL	506	99	80%