@mat3ra/esse 2026.5.30-0 → 2026.6.12-0

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Files changed (38) hide show
  1. package/dist/js/example/core/reusable/formation_energy_contribution.json +9 -0
  2. package/dist/js/example/properties_directory/non_scalar/formation_energy_contributions.json +32 -0
  3. package/dist/js/schema/core/reusable/formation_energy_contribution.json +53 -0
  4. package/dist/js/schema/job.json +15 -28
  5. package/dist/js/schema/properties_directory/enum_options.json +8 -1
  6. package/dist/js/schema/properties_directory/non_scalar/formation_energy_contributions.json +73 -0
  7. package/dist/js/schema/properties_directory/non_scalar/workflow.json +15 -28
  8. package/dist/js/schema/property/holder.json +87 -28
  9. package/dist/js/schema/software_directory/modeling/unit/execution.json +15 -28
  10. package/dist/js/schema/software_directory/scripting/unit/execution.json +15 -28
  11. package/dist/js/schema/workflow/base.json +15 -28
  12. package/dist/js/schema/workflow/subworkflow/mixin.json +15 -28
  13. package/dist/js/schema/workflow/subworkflow/unit.json +15 -28
  14. package/dist/js/schema/workflow/subworkflow.json +15 -28
  15. package/dist/js/schema/workflow/unit/context/_extra_data_material_hash.json +2 -4
  16. package/dist/js/schema/workflow/unit/context/item/boundaryConditions.json +2 -4
  17. package/dist/js/schema/workflow/unit/context/item/collinearMagnetization.json +2 -4
  18. package/dist/js/schema/workflow/unit/context/item/grid.json +2 -4
  19. package/dist/js/schema/workflow/unit/context/item/hubbard_u.json +2 -4
  20. package/dist/js/schema/workflow/unit/context/item/input.json +2 -4
  21. package/dist/js/schema/workflow/unit/context/item/nonCollinearMagnetization.json +2 -4
  22. package/dist/js/schema/workflow/unit/context/item/path.json +2 -4
  23. package/dist/js/schema/workflow/unit/context/item.json +14 -28
  24. package/dist/js/schema/workflow/unit/execution.json +15 -28
  25. package/dist/js/schema/workflow/unit/mixins/execution.json +15 -28
  26. package/dist/js/schema/workflow.json +15 -28
  27. package/dist/js/schemas.json +1 -1
  28. package/dist/js/types.d.ts +505 -100
  29. package/example/core/reusable/formation_energy_contribution.json +9 -0
  30. package/example/properties_directory/non-scalar/formation_energy_contributions.json +32 -0
  31. package/manifest/properties.yaml +5 -0
  32. package/package.json +1 -1
  33. package/schema/core/reusable/formation_energy_contribution.json +53 -0
  34. package/schema/properties_directory/enum_options.json +8 -1
  35. package/schema/properties_directory/non-scalar/formation_energy_contributions.json +24 -0
  36. package/schema/property/holder.json +3 -0
  37. package/schema/workflow/unit/context/_extra_data_material_hash.json +3 -5
  38. package/schema/workflow/unit/mixins/execution.json +1 -0
package/dist/js/schema/workflow/subworkflow.json CHANGED
@@ -1517,6 +1517,7 @@
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  },
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  "context": {
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  "type": "array",
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+ "default": [],
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  "items": {
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "context item schema",
@@ -2218,12 +2219,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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- "type": "string"
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  },
@@ -2354,12 +2353,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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- "type": "string"
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  },
@@ -2415,12 +2412,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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- "type": "string"
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  },
@@ -2529,12 +2524,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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- "type": "string"
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  },
@@ -2736,12 +2729,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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- "type": "string"
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  },
@@ -2942,12 +2933,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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- "type": "string"
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  },
@@ -3091,12 +3080,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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- "type": "string"
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  },
package/dist/js/schema/workflow/unit/context/_extra_data_material_hash.json CHANGED
@@ -3,12 +3,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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- "type": "string"
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  }
package/dist/js/schema/workflow/unit/context/item/boundaryConditions.json CHANGED
@@ -47,12 +47,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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- "type": "string"
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  },
package/dist/js/schema/workflow/unit/context/item/collinearMagnetization.json CHANGED
@@ -66,12 +66,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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- "type": "string"
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  },
package/dist/js/schema/workflow/unit/context/item/grid.json CHANGED
@@ -84,12 +84,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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- "type": "string"
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  },
package/dist/js/schema/workflow/unit/context/item/hubbard_u.json CHANGED
@@ -41,12 +41,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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- "type": "string"
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  },
package/dist/js/schema/workflow/unit/context/item/input.json CHANGED
@@ -696,12 +696,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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- "type": "string"
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  },
package/dist/js/schema/workflow/unit/context/item/nonCollinearMagnetization.json CHANGED
@@ -134,12 +134,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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- "type": "string"
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  },
package/dist/js/schema/workflow/unit/context/item/path.json CHANGED
@@ -46,12 +46,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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- "type": "string"
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  },
package/dist/js/schema/workflow/unit/context/item.json CHANGED
@@ -700,12 +700,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  },
@@ -836,12 +834,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  },
@@ -897,12 +893,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  },
@@ -1011,12 +1005,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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- "type": "string"
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  },
@@ -1218,12 +1210,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  },
@@ -1424,12 +1414,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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- "type": "string"
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  },
@@ -1573,12 +1561,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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- "type": "string"
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  },
package/dist/js/schema/workflow/unit/execution.json CHANGED
@@ -571,6 +571,7 @@
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  },
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  "context": {
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  "type": "array",
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+ "default": [],
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  "items": {
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "context item schema",
@@ -1272,12 +1273,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  },
@@ -1408,12 +1407,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  },
@@ -1469,12 +1466,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- ],
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  "properties": {
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  "materialHash": {
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+ "type": "string",
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  }
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  }
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  },
@@ -1583,12 +1578,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  },
@@ -1790,12 +1783,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- "required": [
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- "materialHash"
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- ],
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  "properties": {
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  "materialHash": {
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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  },
@@ -1996,12 +1987,10 @@
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  "type": "object",
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- ],
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  "properties": {
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+ "type": "string",
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+ "description": "UI only property used to track material change for re-render"
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  }
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  }
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@@ -2145,12 +2134,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "extraData with materialHash schema",
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  "type": "object",
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- ],
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  "properties": {
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  "materialHash": {
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+ "type": "string",
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  }
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  }
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  },
package/dist/js/schema/workflow/unit/mixins/execution.json CHANGED
@@ -400,6 +400,7 @@
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  },
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  "context": {
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  "type": "array",
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+ "default": [],
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  "items": {
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  "$schema": "http://json-schema.org/draft-07/schema#",
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  "title": "context item schema",
@@ -1101,12 +1102,10 @@
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  "$schema": "http://json-schema.org/draft-07/schema#",
1102
1103
  "title": "extraData with materialHash schema",
1103
1104
  "type": "object",
1104
- "required": [
1105
- "materialHash"
1106
- ],
1107
1105
  "properties": {
1108
1106
  "materialHash": {
1109
- "type": "string"
1107
+ "type": "string",
1108
+ "description": "UI only property used to track material change for re-render"
1110
1109
  }
1111
1110
  }
1112
1111
  },
@@ -1237,12 +1236,10 @@
1237
1236
  "$schema": "http://json-schema.org/draft-07/schema#",
1238
1237
  "title": "extraData with materialHash schema",
1239
1238
  "type": "object",
1240
- "required": [
1241
- "materialHash"
1242
- ],
1243
1239
  "properties": {
1244
1240
  "materialHash": {
1245
- "type": "string"
1241
+ "type": "string",
1242
+ "description": "UI only property used to track material change for re-render"
1246
1243
  }
1247
1244
  }
1248
1245
  },
@@ -1298,12 +1295,10 @@
1298
1295
  "$schema": "http://json-schema.org/draft-07/schema#",
1299
1296
  "title": "extraData with materialHash schema",
1300
1297
  "type": "object",
1301
- "required": [
1302
- "materialHash"
1303
- ],
1304
1298
  "properties": {
1305
1299
  "materialHash": {
1306
- "type": "string"
1300
+ "type": "string",
1301
+ "description": "UI only property used to track material change for re-render"
1307
1302
  }
1308
1303
  }
1309
1304
  },
@@ -1412,12 +1407,10 @@
1412
1407
  "$schema": "http://json-schema.org/draft-07/schema#",
1413
1408
  "title": "extraData with materialHash schema",
1414
1409
  "type": "object",
1415
- "required": [
1416
- "materialHash"
1417
- ],
1418
1410
  "properties": {
1419
1411
  "materialHash": {
1420
- "type": "string"
1412
+ "type": "string",
1413
+ "description": "UI only property used to track material change for re-render"
1421
1414
  }
1422
1415
  }
1423
1416
  },
@@ -1619,12 +1612,10 @@
1619
1612
  "$schema": "http://json-schema.org/draft-07/schema#",
1620
1613
  "title": "extraData with materialHash schema",
1621
1614
  "type": "object",
1622
- "required": [
1623
- "materialHash"
1624
- ],
1625
1615
  "properties": {
1626
1616
  "materialHash": {
1627
- "type": "string"
1617
+ "type": "string",
1618
+ "description": "UI only property used to track material change for re-render"
1628
1619
  }
1629
1620
  }
1630
1621
  },
@@ -1825,12 +1816,10 @@
1825
1816
  "$schema": "http://json-schema.org/draft-07/schema#",
1826
1817
  "title": "extraData with materialHash schema",
1827
1818
  "type": "object",
1828
- "required": [
1829
- "materialHash"
1830
- ],
1831
1819
  "properties": {
1832
1820
  "materialHash": {
1833
- "type": "string"
1821
+ "type": "string",
1822
+ "description": "UI only property used to track material change for re-render"
1834
1823
  }
1835
1824
  }
1836
1825
  },
@@ -1974,12 +1963,10 @@
1974
1963
  "$schema": "http://json-schema.org/draft-07/schema#",
1975
1964
  "title": "extraData with materialHash schema",
1976
1965
  "type": "object",
1977
- "required": [
1978
- "materialHash"
1979
- ],
1980
1966
  "properties": {
1981
1967
  "materialHash": {
1982
- "type": "string"
1968
+ "type": "string",
1969
+ "description": "UI only property used to track material change for re-render"
1983
1970
  }
1984
1971
  }
1985
1972
  },