@mat3ra/esse 2026.2.25-0 → 2026.3.7-0
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.
- package/dist/js/schema/compute/nodes/base.json +57 -0
- package/dist/js/schema/compute/nodes/cluster.json +137 -0
- package/dist/js/schema/compute/queue.json +69 -0
- package/dist/js/schema/in_memory_entity/named_defaultable_runtime_items.json +4 -0
- package/dist/js/schema/job/base.json +0 -6
- package/dist/js/schema/job/compute.json +0 -6
- package/dist/js/schema/job.json +120 -30
- package/dist/js/schema/properties_directory/non_scalar/workflow.json +120 -24
- package/dist/js/schema/property/holder.json +120 -24
- package/dist/js/schema/software/application/build_config.json +39 -0
- package/dist/js/schema/software/application.json +5 -6
- package/dist/js/schema/software/application_with_build_config.json +95 -0
- package/dist/js/schema/software/executable.json +4 -0
- package/dist/js/schema/software/flavor.json +4 -0
- package/dist/js/schema/software/template.json +1 -0
- package/dist/js/schema/software_directory/modeling/deepmd.json +5 -6
- package/dist/js/schema/software_directory/modeling/nwchem.json +5 -6
- package/dist/js/schema/software_directory/modeling/unit/execution.json +17 -6
- package/dist/js/schema/software_directory/modeling/vasp.json +5 -6
- package/dist/js/schema/software_directory/scripting/jupyter_lab.json +5 -6
- package/dist/js/schema/software_directory/scripting/python.json +5 -6
- package/dist/js/schema/software_directory/scripting/shell.json +5 -6
- package/dist/js/schema/software_directory/scripting/unit/execution.json +17 -6
- package/dist/js/schema/workflow/base.json +21 -0
- package/dist/js/schema/workflow/base_flow.json +0 -6
- package/dist/js/schema/workflow/subworkflow/unit.json +41 -6
- package/dist/js/schema/workflow/subworkflow.json +50 -18
- package/dist/js/schema/workflow/unit/assertion.json +4 -0
- package/dist/js/schema/workflow/unit/assignment.json +4 -0
- package/dist/js/schema/workflow/unit/base.json +4 -0
- package/dist/js/schema/workflow/unit/condition.json +4 -0
- package/dist/js/schema/workflow/unit/execution.json +17 -6
- package/dist/js/schema/workflow/unit/io.json +4 -0
- package/dist/js/schema/workflow/unit/map.json +4 -0
- package/dist/js/schema/workflow/unit/processing.json +4 -0
- package/dist/js/schema/workflow/unit/reduce.json +4 -0
- package/dist/js/schema/workflow/unit/runtime/_runtime_item_name_object.json +1 -0
- package/dist/js/schema/workflow/unit/runtime/runtime_item.json +1 -0
- package/dist/js/schema/workflow/unit/runtime/runtime_items.json +4 -0
- package/dist/js/schema/workflow/unit/subworkflow.json +4 -0
- package/dist/js/schema/workflow/unit.json +49 -6
- package/dist/js/schema/workflow.json +120 -24
- package/dist/js/schemas.json +1 -1
- package/dist/js/types.d.ts +981 -136
- package/dist/js/utils/ajv.d.ts +4 -2
- package/dist/js/utils/ajv.js +22 -7
- package/package.json +2 -2
- package/schema/compute/nodes/base.json +57 -0
- package/schema/compute/nodes/cluster.json +29 -0
- package/schema/compute/queue.json +69 -0
- package/schema/job/compute.json +1 -29
- package/schema/software/application/build_config.json +39 -0
- package/schema/software/application.json +5 -2
- package/schema/software/application_with_build_config.json +18 -0
- package/schema/workflow/base.json +21 -0
- package/schema/workflow/subworkflow.json +4 -0
- package/schema/workflow/unit/runtime/_runtime_item_name_object.json +1 -0
- package/src/js/utils/ajv.ts +27 -7
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"systemName": {
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"description": "system name of the subworkflow",
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|
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|
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|
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|
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|
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|
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|
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|
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|
"$schema": "http://json-schema.org/draft-07/schema#",
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|
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|
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"shortName": {
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"description": "The short name of the application. e.g. qe",
|
|
@@ -3807,6 +3854,11 @@
|
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|
"description": "Application build. e.g. VTST",
|
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|
"type": "string"
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|
},
|
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|
+
"isDefault": {
|
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|
+
"description": "Whether the build is the default build",
|
|
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|
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|
|
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|
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|
+
},
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|
"hasAdvancedComputeOptions": {
|
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|
"description": "Whether advanced compute options are present",
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|
"type": "boolean"
|
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@@ -3834,11 +3886,6 @@
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|
"name": {
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|
"description": "entity name",
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|
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|
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},
|
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|
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"isDefault": {
|
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|
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"description": "Identifies that entity is defaultable",
|
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|
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"type": "boolean",
|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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|
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@@ -4790,6 +4853,7 @@
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|
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|
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|
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|
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|
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@@ -4820,6 +4884,7 @@
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"type": "string"
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"additionalProperties": true,
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"required": [
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"required": [
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"type": "string"
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"required": [
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"type": "string"
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}
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"additionalProperties": true,
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"required": [
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"type": "string"
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}
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"additionalProperties": true,
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"required": [
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@@ -5120,6 +5189,7 @@
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"type": "string"
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}
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"additionalProperties": true,
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"required": [
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"name"
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]
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@@ -5150,6 +5220,7 @@
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"type": "string"
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}
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"additionalProperties": true,
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"required": [
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"name"
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]
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@@ -5283,6 +5354,7 @@
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"type": "string"
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}
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"additionalProperties": true,
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"required": [
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"name"
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@@ -5313,6 +5385,7 @@
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"type": "string"
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}
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|
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"additionalProperties": true,
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|
"required": [
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"name"
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@@ -5343,6 +5416,7 @@
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"type": "string"
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}
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+
"additionalProperties": true,
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|
"required": [
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"name"
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@@ -5373,6 +5447,7 @@
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|
"type": "string"
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|
}
|
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},
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|
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|
+
"additionalProperties": true,
|
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|
"required": [
|
|
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|
"name"
|
|
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|
]
|
|
@@ -5444,6 +5519,10 @@
|
|
|
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|
"description": "Whether to use the dataset tab in the job designer. Mutually exclusive with using the materials tab.",
|
|
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|
"type": "boolean"
|
|
5446
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|
},
|
|
5522
|
+
"isMultiMaterial": {
|
|
5523
|
+
"description": "Defines whether the workflow is for a multi-material simulation",
|
|
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|
+
"type": "boolean"
|
|
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|
+
},
|
|
5447
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|
"workflows": {
|
|
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|
"description": "Array of workflows with the same schema as the current one.",
|
|
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|
"type": "array",
|
|
@@ -5451,6 +5530,23 @@
|
|
|
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|
"type": "object"
|
|
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|
}
|
|
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|
},
|
|
5533
|
+
"application": {
|
|
5534
|
+
"description": "information about the main application used for workflow categorization by application in standata.",
|
|
5535
|
+
"type": "object",
|
|
5536
|
+
"properties": {
|
|
5537
|
+
"name": {
|
|
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|
+
"description": "name of the application",
|
|
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|
+
"type": "string"
|
|
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|
+
}
|
|
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|
+
}
|
|
5542
|
+
},
|
|
5543
|
+
"tags": {
|
|
5544
|
+
"description": "tags for the workflow",
|
|
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|
+
"type": "array",
|
|
5546
|
+
"items": {
|
|
5547
|
+
"type": "string"
|
|
5548
|
+
}
|
|
5549
|
+
},
|
|
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|
"_id": {
|
|
5455
5551
|
"description": "entity identity",
|
|
5456
5552
|
"type": "string"
|