mat3ra-esse 2025.6.14.post0__py3-none-any.whl → 2025.7.1.post0__py3-none-any.whl

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  1. {mat3ra_esse-2025.6.14.post0.dist-info → mat3ra_esse-2025.7.1.post0.dist-info}/METADATA +2 -2
  2. {mat3ra_esse-2025.6.14.post0.dist-info → mat3ra_esse-2025.7.1.post0.dist-info}/RECORD +5 -118
  3. mat3ra/esse/models/coordinates_shape_enum.py +0 -15
  4. mat3ra/esse/models/core/abstract/2d_data.py +0 -17
  5. mat3ra/esse/models/core/abstract/2d_plot.py +0 -34
  6. mat3ra/esse/models/core/abstract/3d_grid.py +0 -14
  7. mat3ra/esse/models/core/abstract/3d_tensor.py +0 -19
  8. mat3ra/esse/models/core/abstract/3d_vector_basis.py +0 -15
  9. mat3ra/esse/models/core/abstract/_3d_tensor.py +0 -19
  10. mat3ra/esse/models/core/abstract/_3d_vector_basis.py +0 -15
  11. mat3ra/esse/models/core/abstract/point.py +0 -13
  12. mat3ra/esse/models/core/abstract/vector.py +0 -13
  13. mat3ra/esse/models/core/primitive/1d_data_series.py +0 -13
  14. mat3ra/esse/models/core/primitive/3d_lattice.py +0 -34
  15. mat3ra/esse/models/core/primitive/_3d_lattice.py +0 -34
  16. mat3ra/esse/models/core/reusable/accuracy_level.py +0 -27
  17. mat3ra/esse/models/core/reusable/atomic_strings.py +0 -24
  18. mat3ra/esse/models/core/reusable/coordinate_conditions/cylinder.py +0 -26
  19. mat3ra/esse/models/core/reusable/coordinate_conditions/plane.py +0 -24
  20. mat3ra/esse/models/core/reusable/coordinate_conditions/sphere.py +0 -24
  21. mat3ra/esse/models/core/reusable/coordinate_conditions/triangular_prism.py +0 -27
  22. mat3ra/esse/models/core/reusable/energy_accuracy_levels/__init__.py +0 -3
  23. mat3ra/esse/models/core/reusable/energy_accuracy_levels.py +0 -31
  24. mat3ra/esse/models/enums/__init__.py +0 -3
  25. mat3ra/esse/models/enums/chemical_elements.py +0 -13
  26. mat3ra/esse/models/material/builders/base/__init__.py +0 -3
  27. mat3ra/esse/models/material/builders/base/selector_parameters.py +0 -16
  28. mat3ra/esse/models/material/builders/single_material/two_dimensional/slab/__init__.py +0 -3
  29. mat3ra/esse/models/material/builders/single_material/two_dimensional/slab/builder_parameters.py +0 -28
  30. mat3ra/esse/models/material/builders/single_material/two_dimensional/slab/selector_parameters.py +0 -151
  31. mat3ra/esse/models/material/reusable/__init__.py +0 -3
  32. mat3ra/esse/models/material/reusable/coordinate_conditions/__init__.py +0 -3
  33. mat3ra/esse/models/material/reusable/coordinate_conditions/base.py +0 -21
  34. mat3ra/esse/models/material/reusable/coordinate_conditions/box.py +0 -24
  35. mat3ra/esse/models/material/reusable/coordinate_conditions/cylinder.py +0 -26
  36. mat3ra/esse/models/material/reusable/coordinate_conditions/plane.py +0 -24
  37. mat3ra/esse/models/material/reusable/coordinate_conditions/sphere.py +0 -24
  38. mat3ra/esse/models/material/reusable/coordinate_conditions/triangular_prism.py +0 -27
  39. mat3ra/esse/models/material/reusable/repetitions.py +0 -25
  40. mat3ra/esse/models/material/reusable/slab/__init__.py +0 -3
  41. mat3ra/esse/models/material/reusable/slab/enums/__init__.py +0 -3
  42. mat3ra/esse/models/material/reusable/slab/enums/exposed_face.py +0 -13
  43. mat3ra/esse/models/material/reusable/slab/enums.py +0 -13
  44. mat3ra/esse/models/material/reusable/slab/miller_indices.py +0 -16
  45. mat3ra/esse/models/material/reusable/slab/number_of_layers.py +0 -16
  46. mat3ra/esse/models/material/reusable/slab/slab_configuration_with_termination.py +0 -589
  47. mat3ra/esse/models/material/reusable/slab/slab_with_termination.py +0 -593
  48. mat3ra/esse/models/material/reusable/slab/termination.py +0 -144
  49. mat3ra/esse/models/material/reusable/slab/two_slabs_stack.py +0 -618
  50. mat3ra/esse/models/material/reusable/slab/vacuum.py +0 -16
  51. mat3ra/esse/models/material/reusable/slab_configuration_with_termination.py +0 -712
  52. mat3ra/esse/models/material/reusable/stack/__init__.py +0 -3
  53. mat3ra/esse/models/material/reusable/stack/slab_configuration_with_termination.py +0 -593
  54. mat3ra/esse/models/material/reusable/stack/slab_in_stack.py +0 -720
  55. mat3ra/esse/models/material/reusable/stack/stack_of_slabs.py +0 -737
  56. mat3ra/esse/models/material/reusable/stack/stack_of_two_slabs.py +0 -737
  57. mat3ra/esse/models/material/reusable/supercell/__init__.py +0 -3
  58. mat3ra/esse/models/material/reusable/supercell/supercell_matrix_2d.py +0 -25
  59. mat3ra/esse/models/material/reusable/supercell/supercell_matrix_3d.py +0 -27
  60. mat3ra/esse/models/material/reusable/supercell_matrix_2d.py +0 -25
  61. mat3ra/esse/models/material/reusable/supercell_matrix_3d.py +0 -27
  62. mat3ra/esse/models/materials_category/defects/__init__.py +0 -3
  63. mat3ra/esse/models/materials_category/defects/by_host/two_dimensional/adatom/__init__.py +0 -3
  64. mat3ra/esse/models/materials_category/defects/by_host/two_dimensional/adatom/configuration.py +0 -672
  65. mat3ra/esse/models/materials_category/defects/by_host/two_dimensional/layered/__init__.py +0 -3
  66. mat3ra/esse/models/materials_category/defects/by_host/two_dimensional/layered/configuration.py +0 -549
  67. mat3ra/esse/models/materials_category/defects/by_host/two_dimensional/point/__init__.py +0 -3
  68. mat3ra/esse/models/materials_category/defects/by_host/two_dimensional/point/configuration.py +0 -550
  69. mat3ra/esse/models/materials_category/defects/configuration.py +0 -545
  70. mat3ra/esse/models/materials_category/defects/enums/__init__.py +0 -3
  71. mat3ra/esse/models/materials_category/defects/enums/point_defect_type.py +0 -13
  72. mat3ra/esse/models/materials_category/defects/one_dimensional/terrace/__init__.py +0 -3
  73. mat3ra/esse/models/materials_category/defects/one_dimensional/terrace/configuration.py +0 -563
  74. mat3ra/esse/models/materials_category/defects/two_dimensional/grain_boundary_plane/__init__.py +0 -3
  75. mat3ra/esse/models/materials_category/defects/two_dimensional/grain_boundary_plane/configuration.py +0 -1200
  76. mat3ra/esse/models/materials_category/defects/two_dimensional/island/__init__.py +0 -3
  77. mat3ra/esse/models/materials_category/defects/two_dimensional/island/condition_json.py +0 -28
  78. mat3ra/esse/models/materials_category/defects/two_dimensional/island/configuration.py +0 -564
  79. mat3ra/esse/models/materials_category/defects/zero_dimensional/complex/pair/__init__.py +0 -3
  80. mat3ra/esse/models/materials_category/defects/zero_dimensional/complex/pair/configuration.py +0 -1538
  81. mat3ra/esse/models/materials_category/defects/zero_dimensional/point/__init__.py +0 -3
  82. mat3ra/esse/models/materials_category/defects/zero_dimensional/point/configuration.py +0 -672
  83. mat3ra/esse/models/materials_category/defects/zero_dimensional/point/interstitial/__init__.py +0 -3
  84. mat3ra/esse/models/materials_category/defects/zero_dimensional/point/interstitial/configuration.py +0 -672
  85. mat3ra/esse/models/materials_category/defects/zero_dimensional/point/substitution/__init__.py +0 -3
  86. mat3ra/esse/models/materials_category/defects/zero_dimensional/point/substitution/configuration.py +0 -672
  87. mat3ra/esse/models/materials_category/defects/zero_dimensional/point/vacancy/__init__.py +0 -3
  88. mat3ra/esse/models/materials_category/defects/zero_dimensional/point/vacancy/configuration.py +0 -672
  89. mat3ra/esse/models/materials_category/multi_material/interfaces/__init__.py +0 -3
  90. mat3ra/esse/models/materials_category/multi_material/interfaces/configuration.py +0 -737
  91. mat3ra/esse/models/materials_category/single_material/two_dimensional/slab/__init__.py +0 -3
  92. mat3ra/esse/models/materials_category/single_material/two_dimensional/slab/configuration.py +0 -567
  93. mat3ra/esse/models/methods_directory/physical/psp/file/__init__.py +0 -129
  94. mat3ra/esse/models/methods_directory/physical/psp/file_data_item/__init__.py +0 -111
  95. mat3ra/esse/models/properties_directory/structural/lattice/lattice_bravais.py +0 -74
  96. mat3ra/esse/models/property/base/__init__.py +0 -200
  97. mat3ra/esse/models/property/meta/__init__.py +0 -200
  98. mat3ra/esse/models/property/raw/__init__.py +0 -200
  99. mat3ra/esse/models/property/source/__init__.py +0 -150
  100. mat3ra/esse/models/third_party/db/nist_jarvis/2024_3.13/__init__.py +0 -3
  101. mat3ra/esse/models/third_party/db/nist_jarvis/2024_3.13/atoms.py +0 -41
  102. mat3ra/esse/models/third_party/db/nist_jarvis/2024_3.13/db_entry.py +0 -55
  103. mat3ra/esse/models/third_party/file/applications/espresso/7.2/__init__.py +0 -3
  104. mat3ra/esse/models/third_party/file/applications/espresso/7.2/pw.x/__init__.py +0 -3
  105. mat3ra/esse/models/third_party/file/applications/espresso/7.2/pw.x/atomic_positions.py +0 -51
  106. mat3ra/esse/models/third_party/file/applications/espresso/7.2/pw.x/atomic_species.py +0 -34
  107. mat3ra/esse/models/third_party/file/applications/espresso/7.2/pw.x/cell.py +0 -111
  108. mat3ra/esse/models/third_party/file/applications/espresso/7.2/pw.x/cell_parameters.py +0 -36
  109. mat3ra/esse/models/third_party/file/applications/espresso/7.2/pw.x/control.py +0 -169
  110. mat3ra/esse/models/third_party/file/applications/espresso/7.2/pw.x/electrons.py +0 -139
  111. mat3ra/esse/models/third_party/file/applications/espresso/7.2/pw.x/hubbard.py +0 -194
  112. mat3ra/esse/models/third_party/file/applications/espresso/7.2/pw.x/ions.py +0 -422
  113. mat3ra/esse/models/third_party/file/applications/espresso/7.2/pw.x/k_points.py +0 -73
  114. mat3ra/esse/models/third_party/file/applications/espresso/7.2/pw.x/system.py +0 -841
  115. mat3ra/esse/models/third_party/file/applications/espresso/7.2/pw_x.py +0 -1990
  116. {mat3ra_esse-2025.6.14.post0.dist-info → mat3ra_esse-2025.7.1.post0.dist-info}/WHEEL +0 -0
  117. {mat3ra_esse-2025.6.14.post0.dist-info → mat3ra_esse-2025.7.1.post0.dist-info}/licenses/LICENSE.md +0 -0
  118. {mat3ra_esse-2025.6.14.post0.dist-info → mat3ra_esse-2025.7.1.post0.dist-info}/top_level.txt +0 -0
@@ -1,6 +1,6 @@
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  Metadata-Version: 2.4
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  Name: mat3ra-esse
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- Version: 2025.6.14.post0
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+ Version: 2025.7.1.post0
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  Summary: Excellent Source of Schemas and Examples.
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  Author-email: "Exabyte Inc." <info@mat3ra.com>
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  License: # LICENSE
@@ -23,7 +23,7 @@ Classifier: Programming Language :: Python
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  Classifier: Programming Language :: Python :: 3
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  Classifier: Development Status :: 3 - Alpha
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  Classifier: Topic :: Software Development
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- Requires-Python: >=3.8
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+ Requires-Python: >=3.10
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  Description-Content-Type: text/markdown
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  License-File: LICENSE.md
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  Requires-Dist: exabyte-json-include>=2023.12.23.post0
@@ -6,7 +6,6 @@ mat3ra/esse/data/examples.py,sha256=0mxPYRoZ-5_JANeC77Xg67OON8sHTnPi-I0WRS4YA7s,
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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=bVaJZmsSiPCKL6PGVGJZhBQH6WpcKmEvK430k13r-8w,1925090
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  mat3ra/esse/models/__init__.py,sha256=Khec_bQt22_UudNLJljxWJHuNkGBdUPiOQK0weEBcZ4,78
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- mat3ra/esse/models/coordinates_shape_enum.py,sha256=YePazJ_MnDUPF9IwnaiQza0w0DLPm_WpGImQK3TuKGo,319
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@@ -28,29 +27,17 @@ mat3ra/esse/models/apse/file/applications/espresso/7.2/pw.x/system.py,sha256=k1G
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- mat3ra/esse/models/core/abstract/2d_data.py,sha256=QiWkaGXriph7QwLWF3LuRddSal7fLEakNMh2DkuCNCc,426
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- mat3ra/esse/models/core/abstract/2d_plot.py,sha256=q2qJuDQ10UtiJvZcGzWWv9T9qHJ8HwP-kING3w6cUWM,812
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- mat3ra/esse/models/core/abstract/3d_grid.py,sha256=agAv0nKNco8y2baN02wJBkMib6HkW5dKqPuN7hCFGD4,466
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- mat3ra/esse/models/core/abstract/3d_tensor.py,sha256=B-xWWG5PoTfStseeaF27dcFWAcWJH02R9-5h8SgPHyg,564
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- mat3ra/esse/models/core/abstract/3d_vector_basis.py,sha256=p7G-Qld7I6iGWdSjo4IgCj3-aq6zBOhOI3WZQOIjQ0g,564
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- mat3ra/esse/models/core/abstract/point.py,sha256=NNKy1gnTZ8W-7y6-kckKHBHc1gwXvn5g5JSXQJ6yYlM,326
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@@ -83,13 +70,11 @@ mat3ra/esse/models/core/reference/literature/pages.py,sha256=YiXN93a288PnuJ_Ur8e
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@@ -98,7 +83,6 @@ mat3ra/esse/models/core/reusable/categories.py,sha256=Z90c6gdSMUdEYwoThEyusMXb5u
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@@ -362,10 +272,8 @@ mat3ra/esse/models/methods_directory/physical/psp/file.py,sha256=K1-bsq8dbxoGtm3
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@@ -484,7 +392,6 @@ mat3ra/esse/models/properties_directory/structural/basis/atomic_labels.py,sha256
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486
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  mat3ra/esse/models/properties_directory/structural/lattice/__init__.py,sha256=J9gMT0etIOeoJXm0U4ugB9q-zYfI27XNmOnEyqv55YY,2343
487
- mat3ra/esse/models/properties_directory/structural/lattice/lattice_bravais.py,sha256=QytTdHhvhUCCKknKO4-VGNUk-409OokrzvyR7oRy5JE,1546
488
395
  mat3ra/esse/models/properties_directory/structural/lattice/lattice_vectors.py,sha256=NOVgEB8gfdLGewqFk7V6wwT4VILyKeiOIp4fIAcdCrw,655
489
396
  mat3ra/esse/models/properties_directory/structural/lattice/type_enum.py,sha256=gZtoI5CHbSUtr9W-PqWkDBwAN-4eNCRKuEW41ZYOc-Q,448
490
397
  mat3ra/esse/models/properties_directory/structural/lattice/type_extended_enum.py,sha256=jEw00CIiKdPSxpefwR0rwqPkNuIZ1Uq56emjvfQbMvo,725
@@ -506,16 +413,12 @@ mat3ra/esse/models/property/base.py,sha256=mb5Q1XgYt7WrFhUir0O99ufQNzhiJog0yfoqE
506
413
  mat3ra/esse/models/property/meta.py,sha256=i2vBnAMuEmTXNS00Id73OM4SicwTwtmaM8hGJ9-Qucw,4996
507
414
  mat3ra/esse/models/property/raw.py,sha256=OhVfEY-876sr9QwnxuvHGzW_GBhhOcV11rLlASZu_RE,5000
508
415
  mat3ra/esse/models/property/source.py,sha256=lr_eBXAwQ9c_I0hQUFUe9EOg7nDEgoG3CDOnsh_lo_A,3466
509
- mat3ra/esse/models/property/base/__init__.py,sha256=DUlRfAgAm8NPwxpfFNNgHLKEJKKSdVUxBFDVkSgq9ic,5004
510
416
  mat3ra/esse/models/property/base/The_source_of_a_property/__init__.py,sha256=Khec_bQt22_UudNLJljxWJHuNkGBdUPiOQK0weEBcZ4,78
511
417
  mat3ra/esse/models/property/base/The_source_of_a_property/field_This_could_be_an_article__a_simulation_on_Exabyte__an_external_simulation__etc.py,sha256=Ri6Ljt0BIssI8U6wT-84HYlxC3NkRHPrkrAPSy0qPt8,826
512
- mat3ra/esse/models/property/meta/__init__.py,sha256=JCqoIdJmQ9KfnREGOEzlzoXnvy66TqckPSBZz5xKUtM,4997
513
418
  mat3ra/esse/models/property/meta/The_source_of_a_property/__init__.py,sha256=Khec_bQt22_UudNLJljxWJHuNkGBdUPiOQK0weEBcZ4,78
514
419
  mat3ra/esse/models/property/meta/The_source_of_a_property/field_This_could_be_an_article__a_simulation_on_Exabyte__an_external_simulation__etc.py,sha256=APGwKbjHU1X83PXkfG8w7zEwQLdD-2u8qZX7wk5L5k0,826
515
- mat3ra/esse/models/property/raw/__init__.py,sha256=bRctI-s7N3VGpvOuiTBuj60Y7hqlOTRqpn7hi30X4kA,5001
516
420
  mat3ra/esse/models/property/raw/The_source_of_a_property/__init__.py,sha256=Khec_bQt22_UudNLJljxWJHuNkGBdUPiOQK0weEBcZ4,78
517
421
  mat3ra/esse/models/property/raw/The_source_of_a_property/field_This_could_be_an_article__a_simulation_on_Exabyte__an_external_simulation__etc.py,sha256=_d4Ujayas-Ehblbfoq8ooSPTou9ve_3de2gGFXFKwHw,825
518
- mat3ra/esse/models/property/source/__init__.py,sha256=EJixEBrazelX8MdYfS19-BQd3SpNbEXp2-TQmOAv5Ck,3466
519
422
  mat3ra/esse/models/property/source/The_source_of_a_property/__init__.py,sha256=Khec_bQt22_UudNLJljxWJHuNkGBdUPiOQK0weEBcZ4,78
520
423
  mat3ra/esse/models/property/source/The_source_of_a_property/field_This_could_be_an_article__a_simulation_on_Exabyte__an_external_simulation__etc.py,sha256=KUu54vLIk_EiN-kbfBgXPmnqcilU8sxEq87PGEjF-qA,828
521
424
  mat3ra/esse/models/software/__init__.py,sha256=Khec_bQt22_UudNLJljxWJHuNkGBdUPiOQK0weEBcZ4,78
@@ -587,22 +490,6 @@ mat3ra/esse/models/system/status.py,sha256=q1j3BgkOZtTBEVf5-S-4xMteCfpZj23OeXTvk
587
490
  mat3ra/esse/models/system/tags.py,sha256=47rtLMx0uXWXt7SgC1oo_ULTFjAKNy6e-z5dRjA6BbE,297
588
491
  mat3ra/esse/models/system/timestampable.py,sha256=K_OjETeZlGTis8AHWbUDsWfElwdUVOmgb6rd3V01B90,515
589
492
  mat3ra/esse/models/system/use_values.py,sha256=NUupiTBXAV4o0ChySaGAgxIyMvMEoqnb3MUGN1MgSo8,264
590
- mat3ra/esse/models/third_party/db/nist_jarvis/2024_3.13/__init__.py,sha256=Khec_bQt22_UudNLJljxWJHuNkGBdUPiOQK0weEBcZ4,78
591
- mat3ra/esse/models/third_party/db/nist_jarvis/2024_3.13/atoms.py,sha256=cT_8f1J3kqEzzeYQakbbb-TghOH9Q51-lGqHMW-nUO4,1451
592
- mat3ra/esse/models/third_party/db/nist_jarvis/2024_3.13/db_entry.py,sha256=5mzvTHBl53b_v5qXYB9WmPrmFCsrmFQ1--IG0ssuFAc,1909
593
- mat3ra/esse/models/third_party/file/applications/espresso/7.2/__init__.py,sha256=Khec_bQt22_UudNLJljxWJHuNkGBdUPiOQK0weEBcZ4,78
594
- mat3ra/esse/models/third_party/file/applications/espresso/7.2/pw_x.py,sha256=Mb7xzAHQ2Q_gaxVsulzSqN7i0mDr9NpdTUNvVEZCVp4,74719
595
- mat3ra/esse/models/third_party/file/applications/espresso/7.2/pw.x/__init__.py,sha256=Khec_bQt22_UudNLJljxWJHuNkGBdUPiOQK0weEBcZ4,78
596
- mat3ra/esse/models/third_party/file/applications/espresso/7.2/pw.x/atomic_positions.py,sha256=VTVk6tbE8ysJw-omg65lB_zwoCftvtXXCOb8s9mzouY,1271
597
- mat3ra/esse/models/third_party/file/applications/espresso/7.2/pw.x/atomic_species.py,sha256=QANo7AbvPQsyyCHi3s9yn0uiWGaEK-wRmWQLaBIvo_A,1180
598
- mat3ra/esse/models/third_party/file/applications/espresso/7.2/pw.x/cell.py,sha256=NntsVTxamNQus2Kjw7zQzbcA0gzwT8ZG8V9lMwtOonM,3342
599
- mat3ra/esse/models/third_party/file/applications/espresso/7.2/pw.x/cell_parameters.py,sha256=mKZVlTtB_VtkpHdvFc_lNCteGK1icrAcIoS1JYtRj-s,1241
600
- mat3ra/esse/models/third_party/file/applications/espresso/7.2/pw.x/control.py,sha256=wFFFfoVtrZokJUa_Q8E254PQ8jGgue20ChDXKQbht2w,8786
601
- mat3ra/esse/models/third_party/file/applications/espresso/7.2/pw.x/electrons.py,sha256=RSr8tLSEKnvGpHwMCnpvlNOFAoWkoB9hRcCc5qglJEA,4849
602
- mat3ra/esse/models/third_party/file/applications/espresso/7.2/pw.x/hubbard.py,sha256=cpLf1WIFKiBBITOtwdfTMDITey0-RWFt7YYrG0cpxis,4541
603
- mat3ra/esse/models/third_party/file/applications/espresso/7.2/pw.x/ions.py,sha256=x9z_-fv2nLNIvi5DvAnMHsNgfpwxHHm2lesZi8PS_gM,15280
604
- mat3ra/esse/models/third_party/file/applications/espresso/7.2/pw.x/k_points.py,sha256=hsX6lP_-ogOpgASJHNUmHxJzHtODOeUaAIPUVRowTYY,1602
605
- mat3ra/esse/models/third_party/file/applications/espresso/7.2/pw.x/system.py,sha256=f1yAIjBanUacmmB8qG0zGoZNJoStMjOK2b4CldqKnmU,34350
606
493
  mat3ra/esse/models/workflow/__init__.py,sha256=iLO59cteWZYjVsJS5ecF3COT37xI6IdwCegKL3_gZlU,59612
607
494
  mat3ra/esse/models/workflow/base.py,sha256=7dDTOLX9JmBJlimUj8UlCrmKHWNuaOMiQpHGEuS0-IY,1252
608
495
  mat3ra/esse/models/workflow/base_flow.py,sha256=cvAa8lNFHyOyVsqs1dqE6vieRcnET_7Hn-du93BnHKA,5987
@@ -636,8 +523,8 @@ mat3ra/esse/models/workflow/unit/runtime/_runtime_item_name_object.py,sha256=CIb
636
523
  mat3ra/esse/models/workflow/unit/runtime/_runtime_item_string.py,sha256=VouM6ETdIKTiktSTeEpP2pdHZuYHwHrir4W5TLoO_sE,354
637
524
  mat3ra/esse/models/workflow/unit/runtime/runtime_item.py,sha256=PujG7jcL8RDok9RSJiEKEB85-uGLoimVnK2k7gqyf2I,471
638
525
  mat3ra/esse/models/workflow/unit/runtime/runtime_items.py,sha256=Yi53LFKBWqx8oGA1Po38ulfSy-QaBP38VwWk45Q7ZJQ,943
639
- mat3ra_esse-2025.6.14.post0.dist-info/licenses/LICENSE.md,sha256=CBGo1CDw-8EWCk7x9HOiF-OShdnHY6j__TjFyZPpQME,563
640
- mat3ra_esse-2025.6.14.post0.dist-info/METADATA,sha256=XcIsERu6Zd6q33Up3UivLjLoJPzFf9op-gqZMeI4kto,9000
641
- mat3ra_esse-2025.6.14.post0.dist-info/WHEEL,sha256=_zCd3N1l69ArxyTb8rzEoP9TpbYXkqRFSNOD5OuxnTs,91
642
- mat3ra_esse-2025.6.14.post0.dist-info/top_level.txt,sha256=GizAtvIqqIcCWShlThl_mgig_bZs_LFyqVah6wrGHIs,7
643
- mat3ra_esse-2025.6.14.post0.dist-info/RECORD,,
526
+ mat3ra_esse-2025.7.1.post0.dist-info/licenses/LICENSE.md,sha256=CBGo1CDw-8EWCk7x9HOiF-OShdnHY6j__TjFyZPpQME,563
527
+ mat3ra_esse-2025.7.1.post0.dist-info/METADATA,sha256=XfNzLLoYloUiJ2zAuxsbVf8nNJk57vIOTJBxJKtGmvY,9000
528
+ mat3ra_esse-2025.7.1.post0.dist-info/WHEEL,sha256=_zCd3N1l69ArxyTb8rzEoP9TpbYXkqRFSNOD5OuxnTs,91
529
+ mat3ra_esse-2025.7.1.post0.dist-info/top_level.txt,sha256=GizAtvIqqIcCWShlThl_mgig_bZs_LFyqVah6wrGHIs,7
530
+ mat3ra_esse-2025.7.1.post0.dist-info/RECORD,,
@@ -1,15 +0,0 @@
1
- # generated by datamodel-codegen:
2
- # filename: coordinates_shape_enum.json
3
- # version: 0.28.5
4
-
5
- from __future__ import annotations
6
-
7
- from enum import Enum
8
-
9
-
10
- class CoordinateShapeEnum(Enum):
11
- cylinder = "cylinder"
12
- sphere = "sphere"
13
- box = "box"
14
- triangular_prism = "triangular_prism"
15
- plane = "plane"
@@ -1,17 +0,0 @@
1
- # generated by datamodel-codegen:
2
- # filename: core/abstract/2d_data.json
3
- # version: 0.25.5
4
-
5
- from __future__ import annotations
6
-
7
- from typing import List, Union
8
-
9
- from pydantic import BaseModel, Field
10
-
11
-
12
- class Field2DimensionDataSchema(BaseModel):
13
- xDataArray: List
14
- """
15
- array containing values of x Axis
16
- """
17
- yDataSeries: List[List[Union[float, str]]] = Field(..., title="1 dimension data series schema")
@@ -1,34 +0,0 @@
1
- # generated by datamodel-codegen:
2
- # filename: core/abstract/2d_plot.json
3
- # version: 0.25.5
4
-
5
- from __future__ import annotations
6
-
7
- from typing import List, Optional, Union
8
-
9
- from pydantic import BaseModel, Field
10
-
11
-
12
- class AxisSchema(BaseModel):
13
- label: str
14
- """
15
- label of an axis object
16
- """
17
- units: Optional[str] = None
18
- """
19
- units for an axis
20
- """
21
-
22
-
23
- class Field2DimensionPlotSchema(BaseModel):
24
- xAxis: AxisSchema = Field(..., title="axis schema")
25
- yAxis: AxisSchema = Field(..., title="axis schema")
26
- legend: Optional[List] = Field(None, min_length=1)
27
- """
28
- Legend of y Axis data series
29
- """
30
- xDataArray: List
31
- """
32
- array containing values of x Axis
33
- """
34
- yDataSeries: List[List[Union[float, str]]] = Field(..., title="1 dimension data series schema")
@@ -1,14 +0,0 @@
1
- # generated by datamodel-codegen:
2
- # filename: core/abstract/3d_grid.json
3
- # version: 0.25.5
4
-
5
- from __future__ import annotations
6
-
7
- from typing import List
8
-
9
- from pydantic import BaseModel, Field
10
-
11
-
12
- class Field3DimensionalGridSchema(BaseModel):
13
- dimensions: List[float] = Field(..., max_length=3, min_length=3, title="array of 3 number elements schema")
14
- shifts: List[float] = Field(..., max_length=3, min_length=3, title="array of 3 number elements schema")
@@ -1,19 +0,0 @@
1
- # generated by datamodel-codegen:
2
- # filename: core/abstract/3d_tensor.json
3
- # version: 0.25.5
4
-
5
- from __future__ import annotations
6
-
7
- from typing import Any, List
8
-
9
- from pydantic import Field, RootModel
10
-
11
-
12
- class ArrayOf3NumberElementsSchema(RootModel[List[Any]]):
13
- root: List[Any] = Field(..., title="array of 3 number elements schema")
14
-
15
-
16
- class Field3DimensionalTensorSchema(RootModel[List[ArrayOf3NumberElementsSchema]]):
17
- root: List[ArrayOf3NumberElementsSchema] = Field(
18
- ..., max_length=3, min_length=3, title="3 dimensional tensor schema"
19
- )
@@ -1,15 +0,0 @@
1
- # generated by datamodel-codegen:
2
- # filename: core/abstract/3d_vector_basis.json
3
- # version: 0.25.5
4
-
5
- from __future__ import annotations
6
-
7
- from typing import List
8
-
9
- from pydantic import BaseModel, Field
10
-
11
-
12
- class Field3DimensionalVectorBasis(BaseModel):
13
- a: List[float] = Field(..., max_length=3, min_length=3, title="array of 3 number elements schema")
14
- b: List[float] = Field(..., max_length=3, min_length=3, title="array of 3 number elements schema")
15
- c: List[float] = Field(..., max_length=3, min_length=3, title="array of 3 number elements schema")
@@ -1,19 +0,0 @@
1
- # generated by datamodel-codegen:
2
- # filename: core/abstract/3d_tensor.json
3
- # version: 0.28.5
4
-
5
- from __future__ import annotations
6
-
7
- from typing import List
8
-
9
- from pydantic import Field, RootModel
10
-
11
-
12
- class ArrayOf3NumberElementsSchema(RootModel[List[float]]):
13
- root: List[float] = Field(..., title="array of 3 number elements schema")
14
-
15
-
16
- class Field3DimensionalTensorSchema(RootModel[List[ArrayOf3NumberElementsSchema]]):
17
- root: List[ArrayOf3NumberElementsSchema] = Field(
18
- ..., max_length=3, min_length=3, title="3 dimensional tensor schema"
19
- )
@@ -1,15 +0,0 @@
1
- # generated by datamodel-codegen:
2
- # filename: core/abstract/3d_vector_basis.json
3
- # version: 0.28.5
4
-
5
- from __future__ import annotations
6
-
7
- from typing import List
8
-
9
- from pydantic import BaseModel, Field
10
-
11
-
12
- class Field3DimensionalVectorBasis(BaseModel):
13
- a: List[float] = Field(..., max_length=3, min_length=3, title="array of 3 number elements schema")
14
- b: List[float] = Field(..., max_length=3, min_length=3, title="array of 3 number elements schema")
15
- c: List[float] = Field(..., max_length=3, min_length=3, title="array of 3 number elements schema")
@@ -1,13 +0,0 @@
1
- # generated by datamodel-codegen:
2
- # filename: core/abstract/point.json
3
- # version: 0.28.5
4
-
5
- from __future__ import annotations
6
-
7
- from typing import List
8
-
9
- from pydantic import Field, RootModel
10
-
11
-
12
- class PointSchema(RootModel[List[float]]):
13
- root: List[float] = Field(..., max_length=3, min_length=3, title="point schema")
@@ -1,13 +0,0 @@
1
- # generated by datamodel-codegen:
2
- # filename: core/abstract/vector.json
3
- # version: 0.28.5
4
-
5
- from __future__ import annotations
6
-
7
- from typing import List, Union
8
-
9
- from pydantic import Field, RootModel
10
-
11
-
12
- class ESSE(RootModel[Union[List[float], List[bool]]]):
13
- root: Union[List[float], List[bool]] = Field(..., title="vector schema")
@@ -1,13 +0,0 @@
1
- # generated by datamodel-codegen:
2
- # filename: core/primitive/1d_data_series.json
3
- # version: 0.25.5
4
-
5
- from __future__ import annotations
6
-
7
- from typing import List, Union
8
-
9
- from pydantic import Field, RootModel
10
-
11
-
12
- class Field1DimensionDataSeriesSchema(RootModel[List[List[Union[float, str]]]]):
13
- root: List[List[Union[float, str]]] = Field(..., title="1 dimension data series schema")
@@ -1,34 +0,0 @@
1
- # generated by datamodel-codegen:
2
- # filename: core/primitive/3d_lattice.json
3
- # version: 0.25.5
4
-
5
- from __future__ import annotations
6
-
7
- from pydantic import BaseModel
8
-
9
-
10
- class Field3DimensionalLatticeSchema(BaseModel):
11
- a: float
12
- """
13
- length of the first lattice vector
14
- """
15
- b: float
16
- """
17
- length of the second lattice vector
18
- """
19
- c: float
20
- """
21
- length of the third lattice vector
22
- """
23
- alpha: float
24
- """
25
- angle between first and second lattice vector
26
- """
27
- beta: float
28
- """
29
- angle between second and third lattice vector
30
- """
31
- gamma: float
32
- """
33
- angle between first and third lattice vector
34
- """
@@ -1,34 +0,0 @@
1
- # generated by datamodel-codegen:
2
- # filename: core/primitive/3d_lattice.json
3
- # version: 0.28.5
4
-
5
- from __future__ import annotations
6
-
7
- from pydantic import BaseModel
8
-
9
-
10
- class Field3DimensionalLatticeSchema(BaseModel):
11
- a: float
12
- """
13
- length of the first lattice vector
14
- """
15
- b: float
16
- """
17
- length of the second lattice vector
18
- """
19
- c: float
20
- """
21
- length of the third lattice vector
22
- """
23
- alpha: float
24
- """
25
- angle between first and second lattice vector
26
- """
27
- beta: float
28
- """
29
- angle between second and third lattice vector
30
- """
31
- gamma: float
32
- """
33
- angle between first and third lattice vector
34
- """
@@ -1,27 +0,0 @@
1
- # generated by datamodel-codegen:
2
- # filename: core/reusable/accuracy_level.json
3
- # version: 0.25.5
4
-
5
- from __future__ import annotations
6
-
7
- from typing import Optional
8
-
9
- from pydantic import BaseModel, ConfigDict
10
-
11
-
12
- class ReusableAccuracyLevelsSchema(BaseModel):
13
- model_config = ConfigDict(
14
- extra="forbid",
15
- )
16
- standard: Optional[float] = None
17
- """
18
- Parameter value for standard or default accuracy calculation.
19
- """
20
- high: Optional[float] = None
21
- """
22
- Parameter value for high precision calculation.
23
- """
24
- low: Optional[float] = None
25
- """
26
- Parameter value for low precision calculation.
27
- """
@@ -1,24 +0,0 @@
1
- # generated by datamodel-codegen:
2
- # filename: core/reusable/atomic_strings.json
3
- # version: 0.28.5
4
-
5
- from __future__ import annotations
6
-
7
- from typing import List, Optional
8
-
9
- from pydantic import BaseModel, Field, RootModel
10
-
11
-
12
- class AtomicStringsVectorsSchemaItem(BaseModel):
13
- value: Optional[str] = None
14
- id: Optional[int] = None
15
- """
16
- integer id of this entry
17
- """
18
-
19
-
20
- class AtomicStringsVectorsSchema(RootModel[List[AtomicStringsVectorsSchemaItem]]):
21
- root: List[AtomicStringsVectorsSchemaItem] = Field(..., title="atomic strings vectors schema")
22
- """
23
- array of objects containing integer id each
24
- """
@@ -1,26 +0,0 @@
1
- # generated by datamodel-codegen:
2
- # filename: core/reusable/coordinate_conditions/cylinder.json
3
- # version: 0.28.5
4
-
5
- from __future__ import annotations
6
-
7
- from enum import Enum
8
- from typing import List, Literal, Optional
9
-
10
- from pydantic import BaseModel, Field
11
-
12
-
13
- class CoordinateShapeEnum(Enum):
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- cylinder = "cylinder"
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- sphere = "sphere"
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- box = "box"
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- triangular_prism = "triangular_prism"
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- plane = "plane"
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-
20
-
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- class CylinderCoordinateConditionSchema(BaseModel):
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- shape: Literal["cylinder"] = Field(..., title="Coordinate Shape Enum")
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- center_coordinate: Optional[List[float]] = Field(None, max_length=3, min_length=3, title="coordinate 3d schema")
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- radius: float
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- min_z: float
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- max_z: float