mat3ra-esse 2025.4.15.post0__py3-none-any.whl → 2025.4.17.post0__py3-none-any.whl
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- mat3ra/esse/data/schemas.py +1 -1
- mat3ra/esse/models/material/__init__.py +1 -9
- mat3ra/esse/models/properties_directory/structural/lattice/__init__.py +1 -9
- mat3ra/esse/models/properties_directory/structural/lattice/lattice_vectors.py +1 -9
- {mat3ra_esse-2025.4.15.post0.dist-info → mat3ra_esse-2025.4.17.post0.dist-info}/METADATA +1 -1
- {mat3ra_esse-2025.4.15.post0.dist-info → mat3ra_esse-2025.4.17.post0.dist-info}/RECORD +9 -9
- {mat3ra_esse-2025.4.15.post0.dist-info → mat3ra_esse-2025.4.17.post0.dist-info}/WHEEL +0 -0
- {mat3ra_esse-2025.4.15.post0.dist-info → mat3ra_esse-2025.4.17.post0.dist-info}/licenses/LICENSE.md +0 -0
- {mat3ra_esse-2025.4.15.post0.dist-info → mat3ra_esse-2025.4.17.post0.dist-info}/top_level.txt +0 -0
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@@ -43,16 +43,8 @@ class BasisSchema(BaseModel):
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class Units40(Enum):
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km = "km"
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m = "m"
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cm = "cm"
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mm = "mm"
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um = "um"
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nm = "nm"
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angstrom = "angstrom"
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a_u_ = "a.u."
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bohr = "bohr"
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pm = "pm"
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class LatticeExplicitUnit(BaseModel):
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@@ -60,7 +52,7 @@ class LatticeExplicitUnit(BaseModel):
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"""
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lattice parameter for fractional coordinates
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"""
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units: Optional[Units40] =
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units: Optional[Units40] = "angstrom"
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a: List[float] = Field(..., max_length=3, min_length=3, title="array of 3 number elements schema")
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b: List[float] = Field(..., max_length=3, min_length=3, title="array of 3 number elements schema")
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c: List[float] = Field(..., max_length=3, min_length=3, title="array of 3 number elements schema")
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@@ -11,16 +11,8 @@ from pydantic import BaseModel, Field
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class Units(Enum):
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km = "km"
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m = "m"
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cm = "cm"
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mm = "mm"
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um = "um"
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nm = "nm"
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angstrom = "angstrom"
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a_u_ = "a.u."
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bohr = "bohr"
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pm = "pm"
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class LatticeExplicitUnit(BaseModel):
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@@ -28,7 +20,7 @@ class LatticeExplicitUnit(BaseModel):
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"""
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lattice parameter for fractional coordinates
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"""
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units: Optional[Units] =
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units: Optional[Units] = "angstrom"
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a: List[float] = Field(..., max_length=3, min_length=3, title="array of 3 number elements schema")
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b: List[float] = Field(..., max_length=3, min_length=3, title="array of 3 number elements schema")
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c: List[float] = Field(..., max_length=3, min_length=3, title="array of 3 number elements schema")
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@@ -11,16 +11,8 @@ from pydantic import BaseModel, Field
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class Units(Enum):
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km = "km"
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m = "m"
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cm = "cm"
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mm = "mm"
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um = "um"
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nm = "nm"
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angstrom = "angstrom"
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a_u_ = "a.u."
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bohr = "bohr"
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pm = "pm"
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class LatticeExplicitUnit(BaseModel):
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"""
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lattice parameter for fractional coordinates
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"""
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units: Optional[Units] =
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units: Optional[Units] = "angstrom"
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a: List[float] = Field(..., max_length=3, min_length=3, title="array of 3 number elements schema")
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b: List[float] = Field(..., max_length=3, min_length=3, title="array of 3 number elements schema")
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c: List[float] = Field(..., max_length=3, min_length=3, title="array of 3 number elements schema")
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@@ -4,7 +4,7 @@ mat3ra/esse/utils.py,sha256=-FexdtkOYGEWmwJUwWDuJferibc7M1YzUH738Bffuxo,1727
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mat3ra/esse/data/__init__.py,sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU,0
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mat3ra/esse/data/examples.py,sha256=cjPn5WBCnPu1bJl1UYwa32_9S5RAOeHXXWz2sipszb8,46320
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mat3ra/esse/data/properties.py,sha256=geWFIVIJbdn2Q_JG3Mz36oQ_dXeZZwnmlS_NgszvHUY,6099
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mat3ra/esse/data/schemas.py,sha256=
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mat3ra/esse/data/schemas.py,sha256=AQzSuufUkGTyT_qivm7l_7LKJ54IVitSr_NYlG8Fmdk,1572762
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mat3ra/esse/models/__init__.py,sha256=Khec_bQt22_UudNLJljxWJHuNkGBdUPiOQK0weEBcZ4,78
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mat3ra/esse/models/element.py,sha256=y5PJLUMqaRSIAxkqLK42kQNudVsGKV20qTPqO0JaVx8,1331
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mat3ra/esse/models/project.py,sha256=fqUckRBLyCzVc_77-EtQUg_zFDV_zTYfnLmOoE77zPE,1148
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@@ -93,7 +93,7 @@ mat3ra/esse/models/in_memory_entity/named_defaultable_runtime_items.py,sha256=g7
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mat3ra/esse/models/job/__init__.py,sha256=tQXT9GQRHDoVyW9AmI_Sjkqg78fkKSb4tL6TmWn--m4,64815
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mat3ra/esse/models/job/base.py,sha256=QZzYedxsoGbqQvIgLhBsCQDWvTlTgXM64-Jcy-Z4umc,8088
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mat3ra/esse/models/job/compute.py,sha256=strKlGY8VnnnFij3KxxZr2Hozf2_zhujhTb4cQxP5KU,5501
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mat3ra/esse/models/material/__init__.py,sha256=
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mat3ra/esse/models/material/__init__.py,sha256=_bu9a8vzEb2o7dfKYg59dnr3kOhFx1bTe6ATiZro1XI,9378
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mat3ra/esse/models/material/consistency_check.py,sha256=6fF96LF_xOwT4k47Ez3ADx3-yVnREgwY95N5aA12o0c,934
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mat3ra/esse/models/material/conventional.py,sha256=y6PGJsMs4ktea-q9LGZnRIYscFjfWjdZFmeyehAJdBE,303
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mat3ra/esse/models/method/__init__.py,sha256=KErSMWtloFyYMkQVa8lWT-fox0LgnDD3395K9aLbNNY,668
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@@ -327,9 +327,9 @@ mat3ra/esse/models/properties_directory/structural/basis/atomic_coordinates.py,s
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mat3ra/esse/models/properties_directory/structural/basis/atomic_element.py,sha256=iA4qSiilguD0MovUqjBYCZiqYKVEgKuC-fGT99jqKkg,433
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mat3ra/esse/models/properties_directory/structural/basis/atomic_label.py,sha256=Ze5gH0_CVhAJmVKusAvDJoYiH8RsrelAbjaCCqQlWNo,395
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mat3ra/esse/models/properties_directory/structural/basis/bonds.py,sha256=rhr63YAe5T5R8kamscRVbn_W-aNlZhFPyaTmHQcQKMg,936
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mat3ra/esse/models/properties_directory/structural/lattice/__init__.py,sha256=
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mat3ra/esse/models/properties_directory/structural/lattice/__init__.py,sha256=8OKR1nSZU86z-kTMOK_VvzrMQBMLWYUTKGxaU7Lwthg,2165
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mat3ra/esse/models/properties_directory/structural/lattice/lattice_bravais.py,sha256=QytTdHhvhUCCKknKO4-VGNUk-409OokrzvyR7oRy5JE,1546
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mat3ra/esse/models/properties_directory/structural/lattice/lattice_vectors.py,sha256
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mat3ra/esse/models/properties_directory/structural/lattice/lattice_vectors.py,sha256=LsCIHfOlUutjmgsLDdYvkv3SrShPk4PdqpT36GR0Qb0,813
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mat3ra/esse/models/properties_directory/structural/lattice/type_enum.py,sha256=gZtoI5CHbSUtr9W-PqWkDBwAN-4eNCRKuEW41ZYOc-Q,448
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mat3ra/esse/models/properties_directory/structural/lattice/type_extended_enum.py,sha256=jEw00CIiKdPSxpefwR0rwqPkNuIZ1Uq56emjvfQbMvo,725
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mat3ra/esse/models/properties_directory/structural/patterns/__init__.py,sha256=Khec_bQt22_UudNLJljxWJHuNkGBdUPiOQK0weEBcZ4,78
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mat3ra/esse/models/workflow/unit/runtime/_runtime_item_string.py,sha256=VouM6ETdIKTiktSTeEpP2pdHZuYHwHrir4W5TLoO_sE,354
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mat3ra/esse/models/workflow/unit/runtime/runtime_item.py,sha256=PujG7jcL8RDok9RSJiEKEB85-uGLoimVnK2k7gqyf2I,471
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mat3ra/esse/models/workflow/unit/runtime/runtime_items.py,sha256=Yi53LFKBWqx8oGA1Po38ulfSy-QaBP38VwWk45Q7ZJQ,943
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mat3ra_esse-2025.4.
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mat3ra_esse-2025.4.17.post0.dist-info/licenses/LICENSE.md,sha256=CBGo1CDw-8EWCk7x9HOiF-OShdnHY6j__TjFyZPpQME,563
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mat3ra_esse-2025.4.17.post0.dist-info/METADATA,sha256=mqoV4HJPVh64e166GfZfqaP6JZZ7Na8jF0YU6j35do0,9000
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mat3ra_esse-2025.4.17.post0.dist-info/WHEEL,sha256=CmyFI0kx5cdEMTLiONQRbGQwjIoR1aIYB7eCAQ4KPJ0,91
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mat3ra_esse-2025.4.17.post0.dist-info/top_level.txt,sha256=GizAtvIqqIcCWShlThl_mgig_bZs_LFyqVah6wrGHIs,7
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mat3ra_esse-2025.4.17.post0.dist-info/RECORD,,
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{mat3ra_esse-2025.4.15.post0.dist-info → mat3ra_esse-2025.4.17.post0.dist-info}/licenses/LICENSE.md
RENAMED
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{mat3ra_esse-2025.4.15.post0.dist-info → mat3ra_esse-2025.4.17.post0.dist-info}/top_level.txt
RENAMED
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