@mat3ra/esse 2025.5.17-2 → 2025.6.5-0

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.
Files changed (179) hide show
  1. package/dist/js/example/apse/materials/builders/slab/pymatgen/parameters.json +1 -1
  2. package/dist/js/example/materials_category/pristine_structures/two_dimensional/slab.json +160 -0
  3. package/dist/js/example/{material/reusable/supercell → materials_category_components/entities/auxiliary/three_dimensional}/supercell_matrix_3d.json +2 -2
  4. package/dist/js/example/materials_category_components/entities/auxiliary/zero_dimensional/crystal_site.json +7 -0
  5. package/dist/js/example/materials_category_components/entities/core/three_dimensional/crystal.json +128 -0
  6. package/dist/js/example/materials_category_components/entities/core/three_dimensional/void.json +20 -0
  7. package/dist/js/example/materials_category_components/entities/core/two_dimensional/vacuum.json +4 -0
  8. package/dist/js/example/materials_category_components/entities/core/zero_dimensional/atom.json +3 -0
  9. package/dist/js/example/materials_category_components/entities/reusable/repetitions.json +5 -0
  10. package/dist/js/example/{material/reusable/slab_configuration_with_termination.json → materials_category_components/operations/core/combinations/merge.json} +8 -27
  11. package/dist/js/example/materials_category_components/operations/core/combinations/stack.json +137 -0
  12. package/dist/js/example/materials_category_components/operations/core/combinations/stack_component.json +128 -0
  13. package/dist/js/example/materials_category_components/operations/core/modifications/repeat.json +19 -0
  14. package/dist/js/example/materials_category_components/operations/core/modifications/strain.json +19 -0
  15. package/dist/js/schema/apse/materials/builders/slab/pymatgen/parameters.json +3 -3
  16. package/dist/js/schema/core/primitive/array_of_3_integers.json +11 -0
  17. package/dist/js/schema/{materials_category/defects/two_dimensional/island/condition.json.json → core/reusable/coordinate_conditions.json} +4 -2
  18. package/dist/js/schema/materials_category/pristine_structures/three_dimensional/ideal_crystal.json +757 -0
  19. package/dist/js/schema/materials_category/{multi_material/interfaces/configuration.json → pristine_structures/two_dimensional/slab.json} +231 -230
  20. package/dist/js/schema/{material/reusable/supercell → materials_category_components/entities/auxiliary/three_dimensional}/supercell_matrix_3d.json +3 -1
  21. package/dist/js/schema/{material/reusable/slab → materials_category_components/entities/auxiliary/two_dimensional}/miller_indices.json +5 -5
  22. package/dist/js/schema/{material/reusable/supercell → materials_category_components/entities/auxiliary/two_dimensional}/supercell_matrix_2d.json +1 -1
  23. package/dist/js/schema/{material/reusable/slab → materials_category_components/entities/auxiliary/two_dimensional}/termination.json +1 -1
  24. package/dist/js/schema/materials_category_components/entities/auxiliary/zero_dimensional/crystal_site.json +22 -0
  25. package/dist/js/schema/materials_category_components/entities/core/three_dimensional/crystal.json +757 -0
  26. package/dist/js/schema/materials_category_components/entities/core/three_dimensional/void.json +76 -0
  27. package/dist/js/schema/materials_category_components/entities/core/two_dimensional/vacuum.json +30 -0
  28. package/dist/js/schema/materials_category_components/entities/core/zero_dimensional/atom.json +134 -0
  29. package/dist/js/schema/{material → materials_category_components/entities}/reusable/repetitions.json +1 -1
  30. package/dist/js/schema/materials_category_components/entities/reusable/three_dimensional/strained_non_uniform.json +786 -0
  31. package/dist/js/schema/materials_category_components/entities/reusable/three_dimensional/strained_uniform.json +773 -0
  32. package/dist/js/schema/materials_category_components/entities/reusable/three_dimensional/supercell.json +786 -0
  33. package/dist/js/schema/materials_category_components/entities/reusable/two_dimensional/atomic_layers.json +947 -0
  34. package/dist/js/schema/materials_category_components/entities/reusable/two_dimensional/atomic_layers_unique.json +947 -0
  35. package/dist/js/schema/materials_category_components/entities/reusable/two_dimensional/atomic_layers_unique_repeated.json +948 -0
  36. package/dist/js/schema/{materials_category/single_material/two_dimensional/slab/configuration.json → materials_category_components/entities/reusable/two_dimensional/crystal_lattice_planes.json} +16 -59
  37. package/dist/js/schema/{material/reusable/stack/stack_of_slabs.json → materials_category_components/entities/reusable/two_dimensional/slab_unit_cell.json} +207 -230
  38. package/dist/js/schema/materials_category_components/operations/core/combinations/merge.json +884 -0
  39. package/dist/js/schema/materials_category_components/operations/core/combinations/stack.json +818 -0
  40. package/dist/js/schema/materials_category_components/operations/core/combinations/stack_component.json +793 -0
  41. package/dist/js/schema/materials_category_components/operations/core/modifications/repeat.json +42 -0
  42. package/dist/js/schema/materials_category_components/operations/core/modifications/strain.json +24 -0
  43. package/dist/js/schemas.json +1 -1
  44. package/dist/js/types.d.ts +3464 -6059
  45. package/example/apse/materials/builders/slab/pymatgen/parameters.json +1 -1
  46. package/example/materials_category/pristine_structures/two-dimensional/slab.json +35 -0
  47. package/example/materials_category_components/entities/auxiliary/three-dimensional/supercell_matrix_3d.json +5 -0
  48. package/example/materials_category_components/entities/auxiliary/two-dimensional/miller_indices.json +1 -0
  49. package/example/materials_category_components/entities/auxiliary/two-dimensional/supercell_matrix_2d.json +4 -0
  50. package/example/{material/reusable/slab → materials_category_components/entities/auxiliary/two-dimensional}/termination.json +1 -1
  51. package/example/materials_category_components/entities/auxiliary/zero-dimensional/crystal_site.json +3 -0
  52. package/example/materials_category_components/entities/core/three-dimensional/crystal.json +3 -0
  53. package/example/materials_category_components/entities/core/three-dimensional/void.json +8 -0
  54. package/example/materials_category_components/entities/core/two-dimensional/vacuum.json +4 -0
  55. package/example/materials_category_components/entities/core/zero-dimensional/atom.json +3 -0
  56. package/example/materials_category_components/entities/reusable/repetitions.json +1 -0
  57. package/example/materials_category_components/operations/core/combinations/merge.json +11 -0
  58. package/example/materials_category_components/operations/core/combinations/stack.json +11 -0
  59. package/example/materials_category_components/operations/core/combinations/stack_component.json +3 -0
  60. package/example/materials_category_components/operations/core/modifications/repeat.json +13 -0
  61. package/example/materials_category_components/operations/core/modifications/strain.json +7 -0
  62. package/package.json +1 -1
  63. package/schema/apse/materials/builders/slab/pymatgen/parameters.json +3 -3
  64. package/schema/core/primitive/array_of_3_integers.json +11 -0
  65. package/schema/core/reusable/coordinate_conditions/index.json +11 -0
  66. package/schema/materials_category/manifest.yaml +268 -0
  67. package/schema/materials_category/pristine_structures/three-dimensional/ideal_crystal.json +11 -0
  68. package/schema/materials_category/pristine_structures/two-dimensional/slab.json +17 -0
  69. package/schema/{material/reusable/supercell → materials_category_components/entities/auxiliary/three-dimensional}/supercell_matrix_3d.json +2 -7
  70. package/schema/materials_category_components/entities/auxiliary/two-dimensional/miller_indices.json +16 -0
  71. package/schema/{material/reusable/supercell → materials_category_components/entities/auxiliary/two-dimensional}/supercell_matrix_2d.json +1 -1
  72. package/schema/{material/reusable/slab → materials_category_components/entities/auxiliary/two-dimensional}/termination.json +2 -2
  73. package/schema/materials_category_components/entities/auxiliary/zero-dimensional/crystal_site.json +15 -0
  74. package/schema/materials_category_components/entities/core/three-dimensional/crystal.json +11 -0
  75. package/schema/materials_category_components/entities/core/three-dimensional/void.json +19 -0
  76. package/schema/materials_category_components/entities/core/two-dimensional/vacuum.json +22 -0
  77. package/schema/materials_category_components/entities/core/zero-dimensional/atom.json +15 -0
  78. package/schema/{material → materials_category_components/entities}/reusable/repetitions.json +1 -1
  79. package/schema/materials_category_components/entities/reusable/three-dimensional/strained_non_uniform.json +20 -0
  80. package/schema/materials_category_components/entities/reusable/three-dimensional/strained_uniform.json +20 -0
  81. package/schema/materials_category_components/entities/reusable/three-dimensional/supercell.json +20 -0
  82. package/schema/materials_category_components/entities/reusable/two-dimensional/atomic_layers.json +12 -0
  83. package/schema/materials_category_components/entities/reusable/two-dimensional/atomic_layers_unique.json +25 -0
  84. package/schema/materials_category_components/entities/reusable/two-dimensional/atomic_layers_unique_repeated.json +27 -0
  85. package/schema/materials_category_components/entities/reusable/two-dimensional/crystal_lattice_planes.json +25 -0
  86. package/schema/materials_category_components/entities/reusable/two-dimensional/slab_unit_cell.json +33 -0
  87. package/schema/materials_category_components/operations/core/combinations/merge.json +33 -0
  88. package/schema/materials_category_components/operations/core/combinations/stack.json +21 -0
  89. package/schema/materials_category_components/operations/core/combinations/stack_component.json +14 -0
  90. package/schema/materials_category_components/operations/core/modifications/repeat.json +10 -0
  91. package/schema/materials_category_components/operations/core/modifications/strain.json +10 -0
  92. package/dist/js/example/material/builders/base/selector_parameters.json +0 -3
  93. package/dist/js/example/material/builders/single_material/two_dimensional/slab/selector_parameters.json +0 -6
  94. package/dist/js/example/material/reusable/repetitions.json +0 -5
  95. package/dist/js/example/material/reusable/slab/number_of_layers.json +0 -1
  96. package/dist/js/example/material/reusable/slab/vacuum.json +0 -1
  97. package/dist/js/example/materials_category/defects/by_host/two_dimensional/adatom/configuration.json +0 -138
  98. package/dist/js/example/materials_category/defects/by_host/two_dimensional/point/configuration.json +0 -135
  99. package/dist/js/example/materials_category/defects/configuration.json +0 -130
  100. package/dist/js/example/materials_category/defects/one_dimensional/terrace/configuration.json +0 -144
  101. package/dist/js/example/materials_category/defects/two_dimensional/grain_boundary_plane/configuration.json +0 -475
  102. package/dist/js/example/materials_category/defects/zero_dimensional/complex/pair/configuration.json +0 -406
  103. package/dist/js/example/materials_category/defects/zero_dimensional/point/configuration.json +0 -138
  104. package/dist/js/example/materials_category/defects/zero_dimensional/point/interstitial/configuration.json +0 -139
  105. package/dist/js/example/materials_category/defects/zero_dimensional/point/substitution/configuration.json +0 -138
  106. package/dist/js/example/materials_category/defects/zero_dimensional/point/vacancy/configuration.json +0 -137
  107. package/dist/js/example/materials_category/single_material/two_dimensional/slab/configuration.json +0 -150
  108. package/dist/js/schema/material/builders/base/selector_parameters.json +0 -15
  109. package/dist/js/schema/material/builders/single_material/two_dimensional/slab/builder_parameters.json +0 -33
  110. package/dist/js/schema/material/builders/single_material/two_dimensional/slab/selector_parameters.json +0 -159
  111. package/dist/js/schema/material/reusable/slab/enums/exposed_face.json +0 -11
  112. package/dist/js/schema/material/reusable/slab/number_of_layers.json +0 -9
  113. package/dist/js/schema/material/reusable/slab/vacuum.json +0 -9
  114. package/dist/js/schema/material/reusable/slab_configuration_with_termination.json +0 -996
  115. package/dist/js/schema/material/reusable/stack/slab_in_stack.json +0 -1005
  116. package/dist/js/schema/material/reusable/stack/stack_of_two_slabs.json +0 -1033
  117. package/dist/js/schema/materials_category/defects/by_host/two_dimensional/adatom/configuration.json +0 -926
  118. package/dist/js/schema/materials_category/defects/by_host/two_dimensional/layered/configuration.json +0 -794
  119. package/dist/js/schema/materials_category/defects/by_host/two_dimensional/point/configuration.json +0 -803
  120. package/dist/js/schema/materials_category/defects/configuration.json +0 -786
  121. package/dist/js/schema/materials_category/defects/enums/point_defect_type.json +0 -11
  122. package/dist/js/schema/materials_category/defects/one_dimensional/terrace/configuration.json +0 -831
  123. package/dist/js/schema/materials_category/defects/two_dimensional/grain_boundary_plane/configuration.json +0 -2019
  124. package/dist/js/schema/materials_category/defects/two_dimensional/island/configuration.json +0 -845
  125. package/dist/js/schema/materials_category/defects/zero_dimensional/complex/pair/configuration.json +0 -2634
  126. package/dist/js/schema/materials_category/defects/zero_dimensional/point/configuration.json +0 -925
  127. package/dist/js/schema/materials_category/defects/zero_dimensional/point/interstitial/configuration.json +0 -926
  128. package/dist/js/schema/materials_category/defects/zero_dimensional/point/substitution/configuration.json +0 -926
  129. package/dist/js/schema/materials_category/defects/zero_dimensional/point/vacancy/configuration.json +0 -926
  130. package/example/material/builders/base/selector_parameters.json +0 -3
  131. package/example/material/builders/single_material/two_dimensional/slab/selector_parameters.json +0 -6
  132. package/example/material/reusable/repetitions.json +0 -1
  133. package/example/material/reusable/slab/miller_indices.json +0 -5
  134. package/example/material/reusable/slab/number_of_layers.json +0 -1
  135. package/example/material/reusable/slab/vacuum.json +0 -1
  136. package/example/material/reusable/slab_configuration_with_termination.json +0 -8
  137. package/example/material/reusable/supercell/supercell_matrix_2d.json +0 -10
  138. package/example/material/reusable/supercell/supercell_matrix_3d.json +0 -11
  139. package/example/materials_category/defects/by_host/two-dimensional/adatom/configuration.json +0 -11
  140. package/example/materials_category/defects/by_host/two-dimensional/point/configuration.json +0 -8
  141. package/example/materials_category/defects/configuration.json +0 -5
  142. package/example/materials_category/defects/one-dimensional/terrace/configuration.json +0 -19
  143. package/example/materials_category/defects/two-dimensional/grain_boundary_plane/configuration.json +0 -21
  144. package/example/materials_category/defects/zero-dimensional/complex/pair/configuration.json +0 -9
  145. package/example/materials_category/defects/zero-dimensional/point/configuration.json +0 -11
  146. package/example/materials_category/defects/zero-dimensional/point/interstitial/configuration.json +0 -14
  147. package/example/materials_category/defects/zero-dimensional/point/substitution/configuration.json +0 -13
  148. package/example/materials_category/defects/zero-dimensional/point/vacancy/configuration.json +0 -12
  149. package/example/materials_category/single_material/two_dimensional/slab/configuration.json +0 -25
  150. package/schema/material/builders/base/selector_parameters.json +0 -15
  151. package/schema/material/builders/single_material/two_dimensional/slab/builder_parameters.json +0 -12
  152. package/schema/material/builders/single_material/two_dimensional/slab/selector_parameters.json +0 -12
  153. package/schema/material/reusable/slab/enums/exposed_face.json +0 -11
  154. package/schema/material/reusable/slab/miller_indices.json +0 -17
  155. package/schema/material/reusable/slab/number_of_layers.json +0 -9
  156. package/schema/material/reusable/slab/vacuum.json +0 -9
  157. package/schema/material/reusable/slab_configuration_with_termination.json +0 -19
  158. package/schema/material/reusable/stack/slab_in_stack.json +0 -26
  159. package/schema/material/reusable/stack/stack_of_slabs.json +0 -31
  160. package/schema/material/reusable/stack/stack_of_two_slabs.json +0 -17
  161. package/schema/materials_category/defects/by_host/two-dimensional/adatom/configuration.json +0 -16
  162. package/schema/materials_category/defects/by_host/two-dimensional/layered/configuration.json +0 -16
  163. package/schema/materials_category/defects/by_host/two-dimensional/point/configuration.json +0 -26
  164. package/schema/materials_category/defects/configuration.json +0 -34
  165. package/schema/materials_category/defects/one-dimensional/terrace/configuration.json +0 -44
  166. package/schema/materials_category/defects/two-dimensional/grain_boundary_plane/configuration.json +0 -20
  167. package/schema/materials_category/defects/two-dimensional/island/condition.json +0 -9
  168. package/schema/materials_category/defects/two-dimensional/island/configuration.json +0 -18
  169. package/schema/materials_category/defects/zero-dimensional/complex/pair/configuration.json +0 -20
  170. package/schema/materials_category/defects/zero-dimensional/point/configuration.json +0 -34
  171. package/schema/materials_category/defects/zero-dimensional/point/enums/type.json +0 -11
  172. package/schema/materials_category/defects/zero-dimensional/point/interstitial/configuration.json +0 -16
  173. package/schema/materials_category/defects/zero-dimensional/point/substitution/configuration.json +0 -16
  174. package/schema/materials_category/defects/zero-dimensional/point/vacancy/configuration.json +0 -16
  175. package/schema/materials_category/multi-material/interfaces/configuration.json +0 -12
  176. package/schema/materials_category/single_material/two_dimensional/slab/configuration.json +0 -36
  177. /package/dist/js/example/{material/reusable/slab → materials_category_components/entities/auxiliary/two_dimensional}/miller_indices.json +0 -0
  178. /package/dist/js/example/{material/reusable/supercell → materials_category_components/entities/auxiliary/two_dimensional}/supercell_matrix_2d.json +0 -0
  179. /package/dist/js/example/{material/reusable/slab → materials_category_components/entities/auxiliary/two_dimensional}/termination.json +0 -0
@@ -1,130 +0,0 @@
1
- {
2
- "host": {
3
- "_id": "LCthJ6E2QabYCZqf3",
4
- "basis": {
5
- "coordinates": [
6
- {
7
- "id": 1,
8
- "value": [
9
- 0,
10
- 0,
11
- 0
12
- ]
13
- },
14
- {
15
- "id": 2,
16
- "value": [
17
- 0.25,
18
- 0.25,
19
- 0.25
20
- ]
21
- }
22
- ],
23
- "elements": [
24
- {
25
- "id": 1,
26
- "value": "Si"
27
- },
28
- {
29
- "id": 2,
30
- "value": "Si"
31
- }
32
- ],
33
- "name": "basis",
34
- "units": "crystal"
35
- },
36
- "createdAt": "2016-04-03T05:25:37.430Z",
37
- "creator": {
38
- "_id": "HtxACY2wX4b2hS8Rv",
39
- "cls": "User",
40
- "slug": "exadmin"
41
- },
42
- "derivedProperties": [
43
- {
44
- "name": "volume",
45
- "units": "angstrom^3",
46
- "value": 131.1
47
- },
48
- {
49
- "name": "density",
50
- "units": "g/cm^3",
51
- "value": 2.33
52
- },
53
- {
54
- "name": "symmetry",
55
- "spaceGroupSymbol": "Fd-3m",
56
- "tolerance": {
57
- "units": "angstrom",
58
- "value": 0.3
59
- }
60
- },
61
- {
62
- "degree": 10,
63
- "name": "p-norm",
64
- "value": 0.71
65
- },
66
- {
67
- "element": "Si",
68
- "name": "elemental_ratio",
69
- "value": 0.71
70
- },
71
- {
72
- "name": "inchi",
73
- "value": ""
74
- },
75
- {
76
- "name": "inchi_key",
77
- "value": ""
78
- }
79
- ],
80
- "exabyteId": "RKiswuxHKkF3uvLyA",
81
- "formula": "Si",
82
- "hash": "4ac3fa057e3530628eb1295c77110eaa",
83
- "isDefault": false,
84
- "isNonPeriodic": false,
85
- "lattice": {
86
- "name": "lattice",
87
- "a": 5.14,
88
- "alpha": 90,
89
- "b": 5.14,
90
- "beta": 90,
91
- "c": 5.14,
92
- "gamma": 90,
93
- "type": "CUB",
94
- "units": {
95
- "angle": "degree",
96
- "length": "angstrom"
97
- },
98
- "vectors": {
99
- "a": [
100
- 5,
101
- 0.000121312,
102
- 0.000131415
103
- ],
104
- "alat": 1,
105
- "b": [
106
- 0.000121312,
107
- 5,
108
- 0.000121314
109
- ],
110
- "c": [
111
- 0.000121313,
112
- 0.000121312,
113
- 5
114
- ],
115
- "units": "angstrom"
116
- }
117
- },
118
- "name": "Silicon FCC",
119
- "owner": {
120
- "_id": "HtxACY2wX4b2hS8Rv",
121
- "cls": "Account",
122
- "slug": "exabyte"
123
- },
124
- "scaledHash": "5bd4eb168e3530628eb1295d88221cbb",
125
- "schemaVersion": "0.2.0",
126
- "slug": "silicon-fcc",
127
- "unitCellFormula": "Si2",
128
- "updatedAt": "2016-04-04T17:58:42.867Z"
129
- }
130
- }
@@ -1,144 +0,0 @@
1
- {
2
- "host": {
3
- "_id": "LCthJ6E2QabYCZqf3",
4
- "basis": {
5
- "coordinates": [
6
- {
7
- "id": 1,
8
- "value": [
9
- 0,
10
- 0,
11
- 0
12
- ]
13
- },
14
- {
15
- "id": 2,
16
- "value": [
17
- 0.25,
18
- 0.25,
19
- 0.25
20
- ]
21
- }
22
- ],
23
- "elements": [
24
- {
25
- "id": 1,
26
- "value": "Si"
27
- },
28
- {
29
- "id": 2,
30
- "value": "Si"
31
- }
32
- ],
33
- "name": "basis",
34
- "units": "crystal"
35
- },
36
- "createdAt": "2016-04-03T05:25:37.430Z",
37
- "creator": {
38
- "_id": "HtxACY2wX4b2hS8Rv",
39
- "cls": "User",
40
- "slug": "exadmin"
41
- },
42
- "derivedProperties": [
43
- {
44
- "name": "volume",
45
- "units": "angstrom^3",
46
- "value": 131.1
47
- },
48
- {
49
- "name": "density",
50
- "units": "g/cm^3",
51
- "value": 2.33
52
- },
53
- {
54
- "name": "symmetry",
55
- "spaceGroupSymbol": "Fd-3m",
56
- "tolerance": {
57
- "units": "angstrom",
58
- "value": 0.3
59
- }
60
- },
61
- {
62
- "degree": 10,
63
- "name": "p-norm",
64
- "value": 0.71
65
- },
66
- {
67
- "element": "Si",
68
- "name": "elemental_ratio",
69
- "value": 0.71
70
- },
71
- {
72
- "name": "inchi",
73
- "value": ""
74
- },
75
- {
76
- "name": "inchi_key",
77
- "value": ""
78
- }
79
- ],
80
- "exabyteId": "RKiswuxHKkF3uvLyA",
81
- "formula": "Si",
82
- "hash": "4ac3fa057e3530628eb1295c77110eaa",
83
- "isDefault": false,
84
- "isNonPeriodic": false,
85
- "lattice": {
86
- "name": "lattice",
87
- "a": 5.14,
88
- "alpha": 90,
89
- "b": 5.14,
90
- "beta": 90,
91
- "c": 5.14,
92
- "gamma": 90,
93
- "type": "CUB",
94
- "units": {
95
- "angle": "degree",
96
- "length": "angstrom"
97
- },
98
- "vectors": {
99
- "a": [
100
- 5,
101
- 0.000121312,
102
- 0.000131415
103
- ],
104
- "alat": 1,
105
- "b": [
106
- 0.000121312,
107
- 5,
108
- 0.000121314
109
- ],
110
- "c": [
111
- 0.000121313,
112
- 0.000121312,
113
- 5
114
- ],
115
- "units": "angstrom"
116
- }
117
- },
118
- "name": "Silicon FCC",
119
- "owner": {
120
- "_id": "HtxACY2wX4b2hS8Rv",
121
- "cls": "Account",
122
- "slug": "exabyte"
123
- },
124
- "scaledHash": "5bd4eb168e3530628eb1295d88221cbb",
125
- "schemaVersion": "0.2.0",
126
- "slug": "silicon-fcc",
127
- "unitCellFormula": "Si2",
128
- "updatedAt": "2016-04-04T17:58:42.867Z"
129
- },
130
- "number_of_added_layers": 3,
131
- "defect_type": "terrace",
132
- "cut_direction": [
133
- 1,
134
- 0,
135
- 0
136
- ],
137
- "pivot_coordinate": [
138
- 0.5,
139
- 0.5,
140
- 0.5
141
- ],
142
- "use_cartesian_coordinates": false,
143
- "rotate_to_match_pbc": true
144
- }