atomistics 0.2.3__tar.gz → 0.2.4__tar.gz

{atomistics-0.2.3/atomistics.egg-info → atomistics-0.2.4}/PKG-INFO

@@ -1,6 +1,6 @@
 Metadata-Version: 2.2
 Name: atomistics
-Version: 0.2.3
+Version: 0.2.4
 Summary: Interfaces for atomistic simulation codes and workflows
 Author-email: Jan Janssen <janssen@mpie.de>
 License: BSD 3-Clause License
@@ -51,7 +51,7 @@ License-File: LICENSE
 Requires-Dist: ase<=3.24.0,>=3.23.0
 Requires-Dist: numpy==1.26.4
 Requires-Dist: scipy<=1.15.2,>=1.11.1
-Requires-Dist: spglib<=2.5.0,>=2.0.2
+Requires-Dist: spglib<=2.6.0,>=2.0.2
 Provides-Extra: phonopy
 Requires-Dist: phonopy<=2.38.0,>=2.20.0; extra == "phonopy"
 Requires-Dist: seekpath<=2.1.0,>=1.9.0; extra == "phonopy"
@@ -60,12 +60,12 @@ Provides-Extra: gpaw
 Requires-Dist: gpaw<=24.6.0,>=20.1.0; extra == "gpaw"
 Provides-Extra: lammps
 Requires-Dist: pylammpsmpi<=0.2.31,>=0.2.1; extra == "lammps"
-Requires-Dist: jinja2<=3.1.5,>=2.11.3; extra == "lammps"
+Requires-Dist: jinja2<=3.1.6,>=2.11.3; extra == "lammps"
 Requires-Dist: pandas<=2.2.3,>=2.0.3; extra == "lammps"
 Requires-Dist: pyiron_lammps<=0.4.0,>=0.3.2; extra == "lammps"
 Provides-Extra: lammps-phonons
 Requires-Dist: pylammpsmpi<=0.2.31,>=0.2.1; extra == "lammps-phonons"
-Requires-Dist: jinja2<=3.1.5,>=2.11.3; extra == "lammps-phonons"
+Requires-Dist: jinja2<=3.1.6,>=2.11.3; extra == "lammps-phonons"
 Requires-Dist: pandas<=2.2.3,>=2.0.3; extra == "lammps-phonons"
 Requires-Dist: dynaphopy<=1.17.16,>=1.17.5; extra == "lammps-phonons"
 Requires-Dist: pyiron_lammps<=0.4.0,>=0.3.2; extra == "lammps-phonons"

{atomistics-0.2.3 → atomistics-0.2.4}/atomistics/_version.py

@@ -8,11 +8,11 @@ import json
 
 version_json = '''
 {
- "date": "2025-03-06T13:05:02+0100",
+ "date": "2025-03-10T21:45:26+0000",
  "dirty": true,
  "error": null,
- "full-revisionid": "e33c7f32a870e1cab5a615c220fb749bd5665176",
- "version": "0.2.3"
+ "full-revisionid": "bb2b344b87932e4d5e02a4e7f44a87da5c83202b",
+ "version": "0.2.4"
 }
 '''  # END VERSION_JSON
 

{atomistics-0.2.3 → atomistics-0.2.4/atomistics.egg-info}/PKG-INFO

@@ -1,6 +1,6 @@
 Metadata-Version: 2.2
 Name: atomistics
-Version: 0.2.3
+Version: 0.2.4
 Summary: Interfaces for atomistic simulation codes and workflows
 Author-email: Jan Janssen <janssen@mpie.de>
 License: BSD 3-Clause License
@@ -51,7 +51,7 @@ License-File: LICENSE
 Requires-Dist: ase<=3.24.0,>=3.23.0
 Requires-Dist: numpy==1.26.4
 Requires-Dist: scipy<=1.15.2,>=1.11.1
-Requires-Dist: spglib<=2.5.0,>=2.0.2
+Requires-Dist: spglib<=2.6.0,>=2.0.2
 Provides-Extra: phonopy
 Requires-Dist: phonopy<=2.38.0,>=2.20.0; extra == "phonopy"
 Requires-Dist: seekpath<=2.1.0,>=1.9.0; extra == "phonopy"
@@ -60,12 +60,12 @@ Provides-Extra: gpaw
 Requires-Dist: gpaw<=24.6.0,>=20.1.0; extra == "gpaw"
 Provides-Extra: lammps
 Requires-Dist: pylammpsmpi<=0.2.31,>=0.2.1; extra == "lammps"
-Requires-Dist: jinja2<=3.1.5,>=2.11.3; extra == "lammps"
+Requires-Dist: jinja2<=3.1.6,>=2.11.3; extra == "lammps"
 Requires-Dist: pandas<=2.2.3,>=2.0.3; extra == "lammps"
 Requires-Dist: pyiron_lammps<=0.4.0,>=0.3.2; extra == "lammps"
 Provides-Extra: lammps-phonons
 Requires-Dist: pylammpsmpi<=0.2.31,>=0.2.1; extra == "lammps-phonons"
-Requires-Dist: jinja2<=3.1.5,>=2.11.3; extra == "lammps-phonons"
+Requires-Dist: jinja2<=3.1.6,>=2.11.3; extra == "lammps-phonons"
 Requires-Dist: pandas<=2.2.3,>=2.0.3; extra == "lammps-phonons"
 Requires-Dist: dynaphopy<=1.17.16,>=1.17.5; extra == "lammps-phonons"
 Requires-Dist: pyiron_lammps<=0.4.0,>=0.3.2; extra == "lammps-phonons"

{atomistics-0.2.3 → atomistics-0.2.4}/atomistics.egg-info/requires.txt

@@ -1,7 +1,7 @@
 ase<=3.24.0,>=3.23.0
 numpy==1.26.4
 scipy<=1.15.2,>=1.11.1
-spglib<=2.5.0,>=2.0.2
+spglib<=2.6.0,>=2.0.2
 
 [experimental]
 lxml<=5.3.1,>=4.9.1
@@ -14,13 +14,13 @@ gpaw<=24.6.0,>=20.1.0
 
 [lammps]
 pylammpsmpi<=0.2.31,>=0.2.1
-jinja2<=3.1.5,>=2.11.3
+jinja2<=3.1.6,>=2.11.3
 pandas<=2.2.3,>=2.0.3
 pyiron_lammps<=0.4.0,>=0.3.2
 
 [lammps_phonons]
 pylammpsmpi<=0.2.31,>=0.2.1
-jinja2<=3.1.5,>=2.11.3
+jinja2<=3.1.6,>=2.11.3
 pandas<=2.2.3,>=2.0.3
 dynaphopy<=1.17.16,>=1.17.5
 pyiron_lammps<=0.4.0,>=0.3.2

{atomistics-0.2.3 → atomistics-0.2.4}/pyproject.toml

@@ -27,7 +27,7 @@ dependencies = [
     "ase>=3.23.0,<=3.24.0",
     "numpy==1.26.4",
     "scipy>=1.11.1,<=1.15.2",
-    "spglib>=2.0.2,<=2.5.0",
+    "spglib>=2.0.2,<=2.6.0",
 ]
 dynamic = ["version"]
 
@@ -47,13 +47,13 @@ gpaw = [
 ]
 lammps = [
     "pylammpsmpi>=0.2.1,<=0.2.31",
-    "jinja2>=2.11.3,<=3.1.5",
+    "jinja2>=2.11.3,<=3.1.6",
     "pandas>=2.0.3,<=2.2.3",
     "pyiron_lammps>=0.3.2,<=0.4.0",
 ]
 lammps_phonons = [
     "pylammpsmpi>=0.2.1,<=0.2.31",
-    "jinja2>=2.11.3,<=3.1.5",
+    "jinja2>=2.11.3,<=3.1.6",
     "pandas>=2.0.3,<=2.2.3",
     "dynaphopy>=1.17.5,<=1.17.16",
     "pyiron_lammps>=0.3.2,<=0.4.0",