emmet-builders 0.78.6__tar.gz → 0.78.7__tar.gz
This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
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- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/PKG-INFO +1 -1
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet_builders.egg-info/PKG-INFO +1 -1
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/requirements/ubuntu-latest_py3.10.txt +9 -9
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/requirements/ubuntu-latest_py3.10_extras.txt +14 -13
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/requirements/ubuntu-latest_py3.11.txt +9 -9
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/requirements/ubuntu-latest_py3.11_extras.txt +14 -13
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/requirements/ubuntu-latest_py3.9.txt +9 -9
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/requirements/ubuntu-latest_py3.9_extras.txt +14 -13
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/__init__.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/abinit/__init__.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/abinit/phonon.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/abinit/sound_velocity.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/feff/__init__.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/feff/xas.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/__init__.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/absorption_spectrum.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/alloys.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/basic_descriptors.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/bonds.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/chemenv.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/corrected_entries.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/dielectric.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/elasticity.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/electrodes.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/electronic_structure.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/magnetism.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/ml.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/optimade.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/oxidation_states.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/piezoelectric.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/provenance.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/robocrys.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/similarity.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/substrates.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/summary.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/thermo.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/matscholar/missing_compositions.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/mobility/__init__.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/mobility/migration_graph.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/molecules/__init__.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/molecules/atomic.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/molecules/bonds.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/molecules/metal_binding.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/molecules/orbitals.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/molecules/redox.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/molecules/summary.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/molecules/thermo.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/molecules/vibration.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/qchem/__init__.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/qchem/molecules.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/settings.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/utils.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/vasp/__init__.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/vasp/materials.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/vasp/task_validator.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet_builders.egg-info/SOURCES.txt +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet_builders.egg-info/dependency_links.txt +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet_builders.egg-info/not-zip-safe +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet_builders.egg-info/requires.txt +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet_builders.egg-info/top_level.txt +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/requirements/deployment.txt +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/setup.cfg +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/setup.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/__init__.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/conftest.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/molecules/__init__.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/molecules/test_atomic.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/molecules/test_bonds.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/molecules/test_metal_binding.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/molecules/test_orbitals.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/molecules/test_redox.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/molecules/test_summary.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/molecules/test_thermo.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/molecules/test_vibration.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/test_absorption.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/test_basic_descriptors.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/test_chemenv.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/test_corrected_entries_thermo.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/test_dielectric.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/test_elasticity.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/test_electronic_structure.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/test_magnetism.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/test_materials.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/test_ml.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/test_mobility.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/test_oxidation.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/test_piezoelectric.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/test_qchem.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/test_similarity.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/test_summary.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/test_utils.py +0 -0
- {emmet-builders-0.78.6 → emmet-builders-0.78.7}/tests/test_vasp.py +0 -0
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boto3==1.34.
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boto3==1.34.54
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botocore==1.34.
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botocore==1.34.54
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# maggma
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# pymongo
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emmet-core[all,ml]==0.
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emmet-core[all,ml]==0.78.6
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# via anyio
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maggma==0.63.
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maggma==0.63.4
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RENAMED
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{emmet-builders-0.78.6 → emmet-builders-0.78.7}/requirements/ubuntu-latest_py3.11_extras.txt
RENAMED
|
@@ -28,9 +28,9 @@ bcrypt==4.1.2
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# s3transfer
|
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@@ -77,7 +77,7 @@ dnspython==2.6.1
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@@ -106,7 +106,7 @@ future==1.0.0
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@@ -161,7 +161,7 @@ lightning-utilities==0.10.1
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# via
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|
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|
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|
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|
|
@@ -202,7 +203,7 @@ mkdocs==1.5.3
|
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|
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# via mkdocstrings
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|
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# via emmet-builders (setup.py)
|
|
@@ -216,7 +217,7 @@ mkdocs-material-extensions==1.3.1
|
|
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|
|
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|
|
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# via emmet-builders (setup.py)
|
|
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|
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mkdocstrings[python]==0.24.
|
|
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+
mkdocstrings[python]==0.24.1
|
|
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# via
|
|
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|
|
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|
|
@@ -226,7 +227,7 @@ mongogrant==0.3.3
|
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# via maggma
|
|
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|
mongomock==4.1.2
|
|
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|
# via maggma
|
|
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|
-
monty==2024.2.
|
|
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|
+
monty==2024.2.26
|
|
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|
# via
|
|
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|
|
232
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# maggma
|
|
@@ -235,7 +236,7 @@ monty==2024.2.2
|
|
|
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# robocrys
|
|
236
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|
mpmath==1.3.0
|
|
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|
# via sympy
|
|
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|
-
msgpack==1.0.
|
|
239
|
+
msgpack==1.0.8
|
|
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|
# via maggma
|
|
240
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|
multidict==6.0.5
|
|
241
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|
# via
|
|
@@ -363,7 +364,7 @@ pycodestyle==2.11.1
|
|
|
363
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|
# flake8
|
|
364
365
|
pycparser==2.21
|
|
365
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|
# via cffi
|
|
366
|
-
pydantic==2.6.
|
|
367
|
+
pydantic==2.6.3
|
|
367
368
|
# via
|
|
368
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|
# emmet-core
|
|
369
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|
# fastapi
|
|
@@ -384,7 +385,7 @@ pyflakes==3.2.0
|
|
|
384
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|
# via flake8
|
|
385
386
|
pygments==2.17.2
|
|
386
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|
# via mkdocs-material
|
|
387
|
-
pymatgen==2024.
|
|
388
|
+
pymatgen==2024.3.1
|
|
388
389
|
# via
|
|
389
390
|
# chgnet
|
|
390
391
|
# emmet-core
|
|
@@ -417,7 +418,7 @@ pytest==8.0.2
|
|
|
417
418
|
# pytest-cov
|
|
418
419
|
pytest-cov==4.1.0
|
|
419
420
|
# via emmet-builders (setup.py)
|
|
420
|
-
python-dateutil==2.
|
|
421
|
+
python-dateutil==2.9.0.post0
|
|
421
422
|
# via
|
|
422
423
|
# botocore
|
|
423
424
|
# ghp-import
|
|
@@ -536,7 +537,7 @@ triton==2.2.0
|
|
|
536
537
|
# via torch
|
|
537
538
|
types-requests==2.31.0.20240218
|
|
538
539
|
# via emmet-builders (setup.py)
|
|
539
|
-
types-setuptools==69.1.0.
|
|
540
|
+
types-setuptools==69.1.0.20240301
|
|
540
541
|
# via emmet-builders (setup.py)
|
|
541
542
|
typing-extensions==4.10.0
|
|
542
543
|
# via
|
|
@@ -30,9 +30,9 @@ bcrypt==4.1.2
|
|
|
30
30
|
# via paramiko
|
|
31
31
|
blinker==1.7.0
|
|
32
32
|
# via flask
|
|
33
|
-
boto3==1.34.
|
|
33
|
+
boto3==1.34.54
|
|
34
34
|
# via maggma
|
|
35
|
-
botocore==1.34.
|
|
35
|
+
botocore==1.34.54
|
|
36
36
|
# via
|
|
37
37
|
# boto3
|
|
38
38
|
# s3transfer
|
|
@@ -65,7 +65,7 @@ dnspython==2.6.1
|
|
|
65
65
|
# via
|
|
66
66
|
# maggma
|
|
67
67
|
# pymongo
|
|
68
|
-
emmet-core[all,ml]==0.
|
|
68
|
+
emmet-core[all,ml]==0.78.6
|
|
69
69
|
# via emmet-builders (setup.py)
|
|
70
70
|
exceptiongroup==1.2.0
|
|
71
71
|
# via anyio
|
|
@@ -134,7 +134,7 @@ lightning-utilities==0.10.1
|
|
|
134
134
|
# via
|
|
135
135
|
# pytorch-lightning
|
|
136
136
|
# torchmetrics
|
|
137
|
-
maggma==0.63.
|
|
137
|
+
maggma==0.63.4
|
|
138
138
|
# via emmet-builders (setup.py)
|
|
139
139
|
markupsafe==2.1.5
|
|
140
140
|
# via
|
|
@@ -157,7 +157,7 @@ mongogrant==0.3.3
|
|
|
157
157
|
# via maggma
|
|
158
158
|
mongomock==4.1.2
|
|
159
159
|
# via maggma
|
|
160
|
-
monty==2024.2.
|
|
160
|
+
monty==2024.2.26
|
|
161
161
|
# via
|
|
162
162
|
# emmet-core
|
|
163
163
|
# maggma
|
|
@@ -166,7 +166,7 @@ monty==2024.2.2
|
|
|
166
166
|
# robocrys
|
|
167
167
|
mpmath==1.3.0
|
|
168
168
|
# via sympy
|
|
169
|
-
msgpack==1.0.
|
|
169
|
+
msgpack==1.0.8
|
|
170
170
|
# via maggma
|
|
171
171
|
multidict==6.0.5
|
|
172
172
|
# via
|
|
@@ -267,7 +267,7 @@ pybtex==0.24.0
|
|
|
267
267
|
# robocrys
|
|
268
268
|
pycparser==2.21
|
|
269
269
|
# via cffi
|
|
270
|
-
pydantic==2.6.
|
|
270
|
+
pydantic==2.6.3
|
|
271
271
|
# via
|
|
272
272
|
# emmet-core
|
|
273
273
|
# fastapi
|
|
@@ -282,7 +282,7 @@ pydantic-settings==2.2.1
|
|
|
282
282
|
# maggma
|
|
283
283
|
pydash==7.0.7
|
|
284
284
|
# via maggma
|
|
285
|
-
pymatgen==2024.
|
|
285
|
+
pymatgen==2024.3.1
|
|
286
286
|
# via
|
|
287
287
|
# chgnet
|
|
288
288
|
# emmet-core
|
|
@@ -305,7 +305,7 @@ pynacl==1.5.0
|
|
|
305
305
|
# via paramiko
|
|
306
306
|
pyparsing==3.1.1
|
|
307
307
|
# via matplotlib
|
|
308
|
-
python-dateutil==2.
|
|
308
|
+
python-dateutil==2.9.0.post0
|
|
309
309
|
# via
|
|
310
310
|
# botocore
|
|
311
311
|
# maggma
|
|
@@ -30,9 +30,9 @@ bcrypt==4.1.2
|
|
|
30
30
|
# via paramiko
|
|
31
31
|
blinker==1.7.0
|
|
32
32
|
# via flask
|
|
33
|
-
boto3==1.34.
|
|
33
|
+
boto3==1.34.54
|
|
34
34
|
# via maggma
|
|
35
|
-
botocore==1.34.
|
|
35
|
+
botocore==1.34.54
|
|
36
36
|
# via
|
|
37
37
|
# boto3
|
|
38
38
|
# s3transfer
|
|
@@ -79,7 +79,7 @@ dnspython==2.6.1
|
|
|
79
79
|
# via
|
|
80
80
|
# maggma
|
|
81
81
|
# pymongo
|
|
82
|
-
emmet-core[all,ml]==0.
|
|
82
|
+
emmet-core[all,ml]==0.78.6
|
|
83
83
|
# via emmet-builders (setup.py)
|
|
84
84
|
exceptiongroup==1.2.0
|
|
85
85
|
# via
|
|
@@ -112,7 +112,7 @@ future==1.0.0
|
|
|
112
112
|
# uncertainties
|
|
113
113
|
ghp-import==2.1.0
|
|
114
114
|
# via mkdocs
|
|
115
|
-
griffe==0.
|
|
115
|
+
griffe==0.41.1
|
|
116
116
|
# via mkdocstrings-python
|
|
117
117
|
h11==0.14.0
|
|
118
118
|
# via uvicorn
|
|
@@ -175,7 +175,7 @@ lightning-utilities==0.10.1
|
|
|
175
175
|
# torchmetrics
|
|
176
176
|
livereload==2.6.3
|
|
177
177
|
# via emmet-builders (setup.py)
|
|
178
|
-
maggma==0.63.
|
|
178
|
+
maggma==0.63.4
|
|
179
179
|
# via emmet-builders (setup.py)
|
|
180
180
|
markdown==3.5.2
|
|
181
181
|
# via
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@@ -188,6 +188,7 @@ markupsafe==2.1.5
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# via
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# jinja2
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# mkdocs
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+
# mkdocs-autorefs
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# mkdocstrings
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# werkzeug
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matcalc==0.0.4
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@@ -216,7 +217,7 @@ mkdocs==1.5.3
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# mkdocs-material
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# mkdocs-minify-plugin
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# mkdocstrings
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mkdocs-autorefs==0.
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mkdocs-autorefs==1.0.1
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# via mkdocstrings
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mkdocs-awesome-pages-plugin==2.9.2
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# via emmet-builders (setup.py)
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@@ -230,7 +231,7 @@ mkdocs-material-extensions==1.3.1
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# mkdocs-material
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mkdocs-minify-plugin==0.8.0
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# via emmet-builders (setup.py)
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mkdocstrings[python]==0.24.
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mkdocstrings[python]==0.24.1
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# via
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# emmet-builders (setup.py)
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# mkdocstrings-python
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@@ -240,7 +241,7 @@ mongogrant==0.3.3
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# via maggma
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mongomock==4.1.2
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# via maggma
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monty==2024.2.
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monty==2024.2.26
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# via
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# emmet-core
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# maggma
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@@ -249,7 +250,7 @@ monty==2024.2.2
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# robocrys
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mpmath==1.3.0
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# via sympy
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msgpack==1.0.
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msgpack==1.0.8
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# via maggma
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multidict==6.0.5
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# via
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@@ -377,7 +378,7 @@ pycodestyle==2.11.1
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# flake8
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pycparser==2.21
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# via cffi
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pydantic==2.6.
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pydantic==2.6.3
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# via
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# emmet-core
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# fastapi
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@@ -398,7 +399,7 @@ pyflakes==3.2.0
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# via flake8
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pygments==2.17.2
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# via mkdocs-material
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pymatgen==2024.
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pymatgen==2024.3.1
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# via
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# chgnet
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# emmet-core
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@@ -431,7 +432,7 @@ pytest==8.0.2
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# pytest-cov
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pytest-cov==4.1.0
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# via emmet-builders (setup.py)
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python-dateutil==2.
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python-dateutil==2.9.0.post0
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# via
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# botocore
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# ghp-import
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@@ -555,7 +556,7 @@ triton==2.2.0
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# via torch
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types-requests==2.31.0.6
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# via emmet-builders (setup.py)
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types-setuptools==69.1.0.
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types-setuptools==69.1.0.20240301
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# via emmet-builders (setup.py)
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types-urllib3==1.26.25.14
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# via types-requests
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{emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/absorption_spectrum.py
RENAMED
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{emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/basic_descriptors.py
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{emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/corrected_entries.py
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{emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/electronic_structure.py
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{emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/materials/oxidation_states.py
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{emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet/builders/matscholar/missing_compositions.py
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{emmet-builders-0.78.6 → emmet-builders-0.78.7}/emmet_builders.egg-info/dependency_links.txt
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