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003d954
chore: change propery schema title (for TS types)
k0stik Jul 30, 2025
a8da309
Update property base schema and regenerate models
k0stik Jul 31, 2025
49ad75a
Update property base schema and regenerate models
k0stik Aug 1, 2025
83b9326
chore: add required name
k0stik Aug 1, 2025
32f8c6e
chore: improve xDataArray
k0stik Aug 1, 2025
179a887
chore: improve band-gaps schema
k0stik Aug 1, 2025
a819638
chore: required legend
k0stik Aug 4, 2025
087b924
chore: not required legend
k0stik Aug 4, 2025
91a7169
chore: required legend
k0stik Aug 4, 2025
d1d85e1
chore: change schema title
k0stik Aug 4, 2025
d815e01
chore: change schema title
k0stik Aug 4, 2025
d4c4234
chore: change schema title
k0stik Aug 4, 2025
1fe596d
chore: change required values for dielectric-tensor
k0stik Aug 4, 2025
60b4714
chore: required energy for convergence_ionic
k0stik Aug 5, 2025
ab79728
fix: 1d-data-series
k0stik Aug 5, 2025
3168ab0
chore: remove legend from 2d-plot
k0stik Aug 6, 2025
da5ce58
chore: resolve conflicts
k0stik Aug 7, 2025
201253e
fix: properties type
k0stik Aug 7, 2025
53fd1d9
chore: required property.source.info field
k0stik Aug 7, 2025
cd554e8
update: add property holder/meta-holder schemas
k0stik Aug 7, 2025
50bc156
update: make name required in properties
k0stik Aug 8, 2025
fdf52b5
update: add data.repetition field
k0stik Aug 8, 2025
e9123b3
update: add repetition to propery schema
k0stik Aug 8, 2025
268d2de
chore: deps
k0stik Aug 8, 2025
0efcd4c
update: add boundary-conditions
k0stik Aug 11, 2025
7f89874
chore: merge dev
k0stik Aug 15, 2025
3aaab58
chore: change schema title
k0stik Aug 18, 2025
943fd28
update: add predicted-properties
k0stik Aug 19, 2025
60d8bc3
update: add predicted-properties
k0stik Aug 19, 2025
4adc223
update: remove predicted_properties
k0stik Aug 19, 2025
82c5a6a
update: add workflow:pyml_predict property
k0stik Aug 19, 2025
7dd2e7f
chore: add legend to phonon-dos
k0stik Aug 20, 2025
81f588d
chore: remove legend to phonon-dos
k0stik Aug 20, 2025
6b147d6
chore: change property schema titles
k0stik Aug 21, 2025
36e4801
chore: required units in properties
k0stik Aug 21, 2025
86ee679
chore: required units in properties
k0stik Aug 21, 2025
1295241
update: add is_relaxed property
k0stik Aug 21, 2025
d406901
update: add fina_structure property
k0stik Aug 21, 2025
37b6900
update: add required properties
k0stik Aug 21, 2025
da0110d
update: add required properties
k0stik Aug 21, 2025
845808d
chore: create hubbard-parameters schema
k0stik Aug 21, 2025
99fc25e
chore: rename schemas
k0stik Aug 21, 2025
93ee843
chore: add jupyter_notebook_endpoint
k0stik Aug 22, 2025
10c26dd
update: boundary_conditions
k0stik Aug 22, 2025
4547c96
update: remove elemental/ionization_potential.json usage
k0stik Aug 22, 2025
4469bec
update: rquire4d unitns in ionization-potential
k0stik Aug 25, 2025
3a26bf4
update: rquire4d unitns in convergence
k0stik Aug 25, 2025
65e63d5
update: rquired spin/xAxis/yAxis for band_structure
k0stik Aug 25, 2025
cda51e8
fix: examples
k0stik Aug 27, 2025
abb1bf7
fix: holder
k0stik Aug 27, 2025
0053973
fix: holder
k0stik Aug 27, 2025
3f256d5
fix: holder
k0stik Aug 27, 2025
e88bc2d
chore: improve source of proto_holder
k0stik Aug 27, 2025
4157c1f
chore: improve types
k0stik Aug 29, 2025
adf7e3e
chore: file-metadata required properties
k0stik Sep 4, 2025
b00a2ab
fix: proto_holder source
k0stik Sep 4, 2025
30d24cf
fix: io input oneof
k0stik Sep 5, 2025
c7f53d4
fix: draft required/default
k0stik Sep 5, 2025
bae07bb
chore: change anyOf to oneOf in energy.units
k0stik Sep 5, 2025
fec9d75
chore: add discriminator to property holder data
k0stik Sep 5, 2025
c7a747a
chore: remove default for overwrite
k0stik Sep 5, 2025
d44cfe6
chore: clarify worflows properties field
k0stik Sep 5, 2025
825d8a1
chore: return compute for workflows
k0stik Sep 9, 2025
2190e85
update: imprive total-energy-contributions schema
k0stik Sep 12, 2025
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30 changes: 24 additions & 6 deletions dist/js/schema/core/abstract/2d_data.json
Original file line number Diff line number Diff line change
Expand Up @@ -10,7 +10,20 @@
"properties": {
"xDataArray": {
"description": "array containing values of x Axis",
"type": "array"
"type": "array",
"items": {
"oneOf": [
{
"type": "number"
},
{
"type": "array",
"items": {
"type": "number"
}
}
]
}
},
"yDataSeries": {
"$schema": "http://json-schema.org/draft-07/schema#",
Expand All @@ -19,11 +32,16 @@
"items": {
"type": "array",
"minItems": 1,
"items": {
"type": [
"number",
"string"
]
"items": [
{
"type": [
"string",
"number"
]
}
],
"additionalItems": {
"type": "number"
}
}
}
Expand Down
30 changes: 24 additions & 6 deletions dist/js/schema/core/abstract/2d_plot.json
Original file line number Diff line number Diff line change
Expand Up @@ -53,7 +53,20 @@
},
"xDataArray": {
"description": "array containing values of x Axis",
"type": "array"
"type": "array",
"items": {
"oneOf": [
{
"type": "number"
},
{
"type": "array",
"items": {
"type": "number"
}
}
]
}
},
"yDataSeries": {
"$schema": "http://json-schema.org/draft-07/schema#",
Expand All @@ -62,11 +75,16 @@
"items": {
"type": "array",
"minItems": 1,
"items": {
"type": [
"number",
"string"
]
"items": [
{
"type": [
"string",
"number"
]
}
],
"additionalItems": {
"type": "number"
}
}
}
Expand Down
15 changes: 10 additions & 5 deletions dist/js/schema/core/primitive/1d_data_series.json
Original file line number Diff line number Diff line change
Expand Up @@ -6,11 +6,16 @@
"items": {
"type": "array",
"minItems": 1,
"items": {
"type": [
"number",
"string"
]
"items": [
{
"type": [
"string",
"number"
]
}
],
"additionalItems": {
"type": "number"
}
}
}
3 changes: 3 additions & 0 deletions dist/js/schema/element.json
Original file line number Diff line number Diff line change
Expand Up @@ -137,6 +137,7 @@
"description": "atomic radius",
"type": "object",
"required": [
"name",
"value"
],
"properties": {
Expand Down Expand Up @@ -170,6 +171,7 @@
"description": "electronegativity for the element (Pauling scale)",
"type": "object",
"required": [
"name",
"value"
],
"properties": {
Expand All @@ -189,6 +191,7 @@
"description": "ionization potential for the element",
"type": "object",
"required": [
"name",
"value"
],
"properties": {
Expand Down
Original file line number Diff line number Diff line change
Expand Up @@ -5,6 +5,7 @@
"description": "atomic radius",
"type": "object",
"required": [
"name",
"value"
],
"properties": {
Expand Down
Original file line number Diff line number Diff line change
Expand Up @@ -5,6 +5,7 @@
"description": "electronegativity for the element (Pauling scale)",
"type": "object",
"required": [
"name",
"value"
],
"properties": {
Expand Down
Original file line number Diff line number Diff line change
Expand Up @@ -5,6 +5,7 @@
"description": "ionization potential for the element",
"type": "object",
"required": [
"name",
"value"
],
"properties": {
Expand Down
Original file line number Diff line number Diff line change
Expand Up @@ -4,6 +4,7 @@
"title": "average potential profile schema",
"type": "object",
"required": [
"name",
"xAxis",
"xDataArray",
"yAxis",
Expand Down Expand Up @@ -85,7 +86,20 @@
},
"xDataArray": {
"description": "array containing values of x Axis",
"type": "array"
"type": "array",
"items": {
"oneOf": [
{
"type": "number"
},
{
"type": "array",
"items": {
"type": "number"
}
}
]
}
},
"yDataSeries": {
"$schema": "http://json-schema.org/draft-07/schema#",
Expand All @@ -94,11 +108,16 @@
"items": {
"type": "array",
"minItems": 1,
"items": {
"type": [
"number",
"string"
]
"items": [
{
"type": [
"string",
"number"
]
}
],
"additionalItems": {
"type": "number"
}
}
}
Expand Down
Original file line number Diff line number Diff line change
Expand Up @@ -5,7 +5,8 @@
"description": "contains band gap values",
"type": "object",
"required": [
"name"
"name",
"values"
],
"properties": {
"name": {
Expand Down
31 changes: 25 additions & 6 deletions dist/js/schema/properties_directory/non_scalar/band_structure.json
Original file line number Diff line number Diff line change
Expand Up @@ -4,6 +4,7 @@
"title": "band structure schema",
"type": "object",
"required": [
"name",
"xAxis",
"xDataArray",
"yAxis",
Expand Down Expand Up @@ -89,7 +90,20 @@
},
"xDataArray": {
"description": "array containing values of x Axis",
"type": "array"
"type": "array",
"items": {
"oneOf": [
{
"type": "number"
},
{
"type": "array",
"items": {
"type": "number"
}
}
]
}
},
"yDataSeries": {
"$schema": "http://json-schema.org/draft-07/schema#",
Expand All @@ -98,11 +112,16 @@
"items": {
"type": "array",
"minItems": 1,
"items": {
"type": [
"number",
"string"
]
"items": [
{
"type": [
"string",
"number"
]
}
],
"additionalItems": {
"type": "number"
}
}
}
Expand Down
Original file line number Diff line number Diff line change
Expand Up @@ -4,6 +4,7 @@
"title": "charge density profile schema",
"type": "object",
"required": [
"name",
"xAxis",
"xDataArray",
"yAxis",
Expand Down Expand Up @@ -67,7 +68,20 @@
},
"xDataArray": {
"description": "array containing values of x Axis",
"type": "array"
"type": "array",
"items": {
"oneOf": [
{
"type": "number"
},
{
"type": "array",
"items": {
"type": "number"
}
}
]
}
},
"yDataSeries": {
"$schema": "http://json-schema.org/draft-07/schema#",
Expand All @@ -76,11 +90,16 @@
"items": {
"type": "array",
"minItems": 1,
"items": {
"type": [
"number",
"string"
]
"items": [
{
"type": [
"string",
"number"
]
}
],
"additionalItems": {
"type": "number"
}
}
}
Expand Down
Original file line number Diff line number Diff line change
Expand Up @@ -4,6 +4,8 @@
"title": "density of states schema",
"type": "object",
"required": [
"legend",
"name",
"xAxis",
"xDataArray",
"yAxis",
Expand Down Expand Up @@ -102,7 +104,20 @@
},
"xDataArray": {
"description": "array containing values of x Axis",
"type": "array"
"type": "array",
"items": {
"oneOf": [
{
"type": "number"
},
{
"type": "array",
"items": {
"type": "number"
}
}
]
}
},
"yDataSeries": {
"$schema": "http://json-schema.org/draft-07/schema#",
Expand All @@ -111,11 +126,16 @@
"items": {
"type": "array",
"minItems": 1,
"items": {
"type": [
"number",
"string"
]
"items": [
{
"type": [
"string",
"number"
]
}
],
"additionalItems": {
"type": "number"
}
}
}
Expand Down
Original file line number Diff line number Diff line change
@@ -1,11 +1,12 @@
{
"$id": "properties-directory/non-scalar/dielectric-tensor",
"$schema": "http://json-schema.org/draft-07/schema#",
"title": "dielectric tensor property",
"title": "dielectric tensor property schema",
"description": "The real and imaginary parts of the diagonal elements of the dieletric tensor",
"type": "object",
"required": [
"name"
"name",
"values"
],
"properties": {
"name": {
Expand Down
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