@mat3ra/esse 2026.5.28-0 → 2026.6.5-0

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 (42) hide show
  1. package/dist/js/esse/JSONSchemasInterface.js +1 -1
  2. package/dist/js/esse/JSONSchemasInterfaceServer.js +2 -3
  3. package/dist/js/esse/schemaUtils.js +1 -2
  4. package/dist/js/esse/server/utils.js +2 -3
  5. package/dist/js/esse/utils.js +2 -3
  6. package/dist/js/schema/job.json +15 -28
  7. package/dist/js/schema/properties_directory/enum_options.json +1 -0
  8. package/dist/js/schema/properties_directory/non_scalar/workflow.json +15 -28
  9. package/dist/js/schema/property/holder.json +57 -28
  10. package/dist/js/schema/software_directory/modeling/unit/execution.json +15 -28
  11. package/dist/js/schema/software_directory/scripting/unit/execution.json +15 -28
  12. package/dist/js/schema/workflow/base.json +15 -28
  13. package/dist/js/schema/workflow/subworkflow/mixin.json +15 -28
  14. package/dist/js/schema/workflow/subworkflow/unit.json +15 -28
  15. package/dist/js/schema/workflow/subworkflow.json +15 -28
  16. package/dist/js/schema/workflow/unit/context/_extra_data_material_hash.json +2 -4
  17. package/dist/js/schema/workflow/unit/context/item/boundaryConditions.json +2 -4
  18. package/dist/js/schema/workflow/unit/context/item/collinearMagnetization.json +2 -4
  19. package/dist/js/schema/workflow/unit/context/item/grid.json +2 -4
  20. package/dist/js/schema/workflow/unit/context/item/hubbard_u.json +2 -4
  21. package/dist/js/schema/workflow/unit/context/item/input.json +2 -4
  22. package/dist/js/schema/workflow/unit/context/item/nonCollinearMagnetization.json +2 -4
  23. package/dist/js/schema/workflow/unit/context/item/path.json +2 -4
  24. package/dist/js/schema/workflow/unit/context/item.json +14 -28
  25. package/dist/js/schema/workflow/unit/execution.json +15 -28
  26. package/dist/js/schema/workflow/unit/mixins/execution.json +15 -28
  27. package/dist/js/schema/workflow.json +15 -28
  28. package/dist/js/schemas.json +1 -1
  29. package/dist/js/scripts/compileTs.js +1 -1
  30. package/dist/js/scripts/setSchemaIds.js +1 -1
  31. package/dist/js/types.d.ts +401 -100
  32. package/dist/js/types.js +5 -5
  33. package/dist/js/utils/ajv.js +4 -5
  34. package/dist/js/utils/common.js +2 -3
  35. package/dist/js/utils/filesystem.js +2 -3
  36. package/manifest/properties.yaml +6 -0
  37. package/package.json +1 -1
  38. package/schema/properties_directory/enum_options.json +2 -0
  39. package/schema/properties_directory/scalar/formation_energy.json +2 -1
  40. package/schema/property/holder.json +4 -0
  41. package/schema/workflow/unit/context/_extra_data_material_hash.json +3 -5
  42. package/schema/workflow/unit/mixins/execution.json +1 -0
@@ -7148,7 +7148,10 @@ export interface JobSchema {
7148
7148
  contextProviderName: "vasp-neb";
7149
7149
  };
7150
7150
  extraData: {
7151
- materialHash: string;
7151
+ /**
7152
+ * UI only property used to track material change for re-render
7153
+ */
7154
+ materialHash?: string;
7152
7155
  };
7153
7156
  isEdited: boolean;
7154
7157
  } | {
@@ -7184,7 +7187,10 @@ export interface JobSchema {
7184
7187
  preferGridMetric?: boolean;
7185
7188
  };
7186
7189
  extraData: {
7187
- materialHash: string;
7190
+ /**
7191
+ * UI only property used to track material change for re-render
7192
+ */
7193
+ materialHash?: string;
7188
7194
  };
7189
7195
  isEdited: boolean;
7190
7196
  } | {
@@ -7205,7 +7211,10 @@ export interface JobSchema {
7205
7211
  }[]
7206
7212
  ];
7207
7213
  extraData: {
7208
- materialHash: string;
7214
+ /**
7215
+ * UI only property used to track material change for re-render
7216
+ */
7217
+ materialHash?: string;
7209
7218
  };
7210
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  isEdited: boolean;
7211
7220
  } | {
@@ -7242,7 +7251,10 @@ export interface JobSchema {
7242
7251
  hubbardUValue?: number;
7243
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  }[];
7244
7253
  extraData: {
7245
- materialHash: string;
7254
+ /**
7255
+ * UI only property used to track material change for re-render
7256
+ */
7257
+ materialHash?: string;
7246
7258
  };
7247
7259
  isEdited: boolean;
7248
7260
  } | {
@@ -7317,7 +7329,10 @@ export interface JobSchema {
7317
7329
  targetFermiEnergy?: number;
7318
7330
  };
7319
7331
  extraData: {
7320
- materialHash: string;
7332
+ /**
7333
+ * UI only property used to track material change for re-render
7334
+ */
7335
+ materialHash?: string;
7321
7336
  };
7322
7337
  isEdited: boolean;
7323
7338
  } | {
@@ -7369,7 +7384,10 @@ export interface JobSchema {
7369
7384
  totalMagnetization: number;
7370
7385
  };
7371
7386
  extraData: {
7372
- materialHash: string;
7387
+ /**
7388
+ * UI only property used to track material change for re-render
7389
+ */
7390
+ materialHash?: string;
7373
7391
  };
7374
7392
  isEdited: boolean;
7375
7393
  } | {
@@ -7407,7 +7425,10 @@ export interface JobSchema {
7407
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  };
7408
7426
  };
7409
7427
  extraData: {
7410
- materialHash: string;
7428
+ /**
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+ * UI only property used to track material change for re-render
7430
+ */
7431
+ materialHash?: string;
7411
7432
  };
7412
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  isEdited: boolean;
7413
7434
  })[];
@@ -52195,7 +52216,7 @@ export type PropertyType = "scalar" | "non-scalar" | "tensor" | "object";
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  * This interface was referenced by `PropertiesDirectoryEnumOptions`'s JSON-Schema
52196
52217
  * via the `definition` "ScalarPropertyEnum".
52197
52218
  */
52198
- export type ScalarPropertyEnum = "fermi_energy" | "homo_energy" | "ionization_potential" | "lumo_energy" | "pressure" | "reaction_energy_barrier" | "surface_energy" | "thermal_correction_to_energy" | "thermal_correction_to_enthalpy" | "total_energy" | "total_force" | "valence_band_offset" | "zero_point_energy";
52219
+ export type ScalarPropertyEnum = "fermi_energy" | "formation_energy" | "homo_energy" | "ionization_potential" | "lumo_energy" | "pressure" | "reaction_energy_barrier" | "surface_energy" | "thermal_correction_to_energy" | "thermal_correction_to_enthalpy" | "total_energy" | "total_force" | "valence_band_offset" | "zero_point_energy";
52199
52220
  /**
52200
52221
  * This interface was referenced by `PropertiesDirectoryEnumOptions`'s JSON-Schema
52201
52222
  * via the `definition` "NonScalarPropertyEnum".
@@ -54186,7 +54207,10 @@ export interface WorkflowPropertySchema {
54186
54207
  contextProviderName: "vasp-neb";
54187
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  };
54188
54209
  extraData: {
54189
- materialHash: string;
54210
+ /**
54211
+ * UI only property used to track material change for re-render
54212
+ */
54213
+ materialHash?: string;
54190
54214
  };
54191
54215
  isEdited: boolean;
54192
54216
  } | {
@@ -54222,7 +54246,10 @@ export interface WorkflowPropertySchema {
54222
54246
  preferGridMetric?: boolean;
54223
54247
  };
54224
54248
  extraData: {
54225
- materialHash: string;
54249
+ /**
54250
+ * UI only property used to track material change for re-render
54251
+ */
54252
+ materialHash?: string;
54226
54253
  };
54227
54254
  isEdited: boolean;
54228
54255
  } | {
@@ -54243,7 +54270,10 @@ export interface WorkflowPropertySchema {
54243
54270
  }[]
54244
54271
  ];
54245
54272
  extraData: {
54246
- materialHash: string;
54273
+ /**
54274
+ * UI only property used to track material change for re-render
54275
+ */
54276
+ materialHash?: string;
54247
54277
  };
54248
54278
  isEdited: boolean;
54249
54279
  } | {
@@ -54280,7 +54310,10 @@ export interface WorkflowPropertySchema {
54280
54310
  hubbardUValue?: number;
54281
54311
  }[];
54282
54312
  extraData: {
54283
- materialHash: string;
54313
+ /**
54314
+ * UI only property used to track material change for re-render
54315
+ */
54316
+ materialHash?: string;
54284
54317
  };
54285
54318
  isEdited: boolean;
54286
54319
  } | {
@@ -54355,7 +54388,10 @@ export interface WorkflowPropertySchema {
54355
54388
  targetFermiEnergy?: number;
54356
54389
  };
54357
54390
  extraData: {
54358
- materialHash: string;
54391
+ /**
54392
+ * UI only property used to track material change for re-render
54393
+ */
54394
+ materialHash?: string;
54359
54395
  };
54360
54396
  isEdited: boolean;
54361
54397
  } | {
@@ -54407,7 +54443,10 @@ export interface WorkflowPropertySchema {
54407
54443
  totalMagnetization: number;
54408
54444
  };
54409
54445
  extraData: {
54410
- materialHash: string;
54446
+ /**
54447
+ * UI only property used to track material change for re-render
54448
+ */
54449
+ materialHash?: string;
54411
54450
  };
54412
54451
  isEdited: boolean;
54413
54452
  } | {
@@ -54445,7 +54484,10 @@ export interface WorkflowPropertySchema {
54445
54484
  };
54446
54485
  };
54447
54486
  extraData: {
54448
- materialHash: string;
54487
+ /**
54488
+ * UI only property used to track material change for re-render
54489
+ */
54490
+ materialHash?: string;
54449
54491
  };
54450
54492
  isEdited: boolean;
54451
54493
  })[];
@@ -55908,6 +55950,10 @@ export interface PropertyHolderSchema {
55908
55950
  name: "fermi_energy";
55909
55951
  units: ("kcal/mol" | "kJ/mol" | "eV" | "J/mol" | "hartree" | "cm-1" | "Ry" | "eV/atom") | "eV/A^2";
55910
55952
  value: number;
55953
+ } | {
55954
+ name: "formation_energy";
55955
+ units: ("kcal/mol" | "kJ/mol" | "eV" | "J/mol" | "hartree" | "cm-1" | "Ry" | "eV/atom") | "eV/A^2";
55956
+ value: number;
55911
55957
  } | {
55912
55958
  name: "homo_energy";
55913
55959
  units: ("kcal/mol" | "kJ/mol" | "eV" | "J/mol" | "hartree" | "cm-1" | "Ry" | "eV/atom") | "eV/A^2";
@@ -57778,7 +57824,10 @@ export interface PropertyHolderSchema {
57778
57824
  contextProviderName: "vasp-neb";
57779
57825
  };
57780
57826
  extraData: {
57781
- materialHash: string;
57827
+ /**
57828
+ * UI only property used to track material change for re-render
57829
+ */
57830
+ materialHash?: string;
57782
57831
  };
57783
57832
  isEdited: boolean;
57784
57833
  } | {
@@ -57814,7 +57863,10 @@ export interface PropertyHolderSchema {
57814
57863
  preferGridMetric?: boolean;
57815
57864
  };
57816
57865
  extraData: {
57817
- materialHash: string;
57866
+ /**
57867
+ * UI only property used to track material change for re-render
57868
+ */
57869
+ materialHash?: string;
57818
57870
  };
57819
57871
  isEdited: boolean;
57820
57872
  } | {
@@ -57835,7 +57887,10 @@ export interface PropertyHolderSchema {
57835
57887
  }[]
57836
57888
  ];
57837
57889
  extraData: {
57838
- materialHash: string;
57890
+ /**
57891
+ * UI only property used to track material change for re-render
57892
+ */
57893
+ materialHash?: string;
57839
57894
  };
57840
57895
  isEdited: boolean;
57841
57896
  } | {
@@ -57872,7 +57927,10 @@ export interface PropertyHolderSchema {
57872
57927
  hubbardUValue?: number;
57873
57928
  }[];
57874
57929
  extraData: {
57875
- materialHash: string;
57930
+ /**
57931
+ * UI only property used to track material change for re-render
57932
+ */
57933
+ materialHash?: string;
57876
57934
  };
57877
57935
  isEdited: boolean;
57878
57936
  } | {
@@ -57947,7 +58005,10 @@ export interface PropertyHolderSchema {
57947
58005
  targetFermiEnergy?: number;
57948
58006
  };
57949
58007
  extraData: {
57950
- materialHash: string;
58008
+ /**
58009
+ * UI only property used to track material change for re-render
58010
+ */
58011
+ materialHash?: string;
57951
58012
  };
57952
58013
  isEdited: boolean;
57953
58014
  } | {
@@ -57999,7 +58060,10 @@ export interface PropertyHolderSchema {
57999
58060
  totalMagnetization: number;
58000
58061
  };
58001
58062
  extraData: {
58002
- materialHash: string;
58063
+ /**
58064
+ * UI only property used to track material change for re-render
58065
+ */
58066
+ materialHash?: string;
58003
58067
  };
58004
58068
  isEdited: boolean;
58005
58069
  } | {
@@ -58037,7 +58101,10 @@ export interface PropertyHolderSchema {
58037
58101
  };
58038
58102
  };
58039
58103
  extraData: {
58040
- materialHash: string;
58104
+ /**
58105
+ * UI only property used to track material change for re-render
58106
+ */
58107
+ materialHash?: string;
58041
58108
  };
58042
58109
  isEdited: boolean;
58043
58110
  })[];
@@ -60538,7 +60605,10 @@ export interface ExecutionUnitSchemaForPhysicsBasedSimulationEnginesDefinedUsing
60538
60605
  contextProviderName: "vasp-neb";
60539
60606
  };
60540
60607
  extraData: {
60541
- materialHash: string;
60608
+ /**
60609
+ * UI only property used to track material change for re-render
60610
+ */
60611
+ materialHash?: string;
60542
60612
  };
60543
60613
  isEdited: boolean;
60544
60614
  } | {
@@ -60574,7 +60644,10 @@ export interface ExecutionUnitSchemaForPhysicsBasedSimulationEnginesDefinedUsing
60574
60644
  preferGridMetric?: boolean;
60575
60645
  };
60576
60646
  extraData: {
60577
- materialHash: string;
60647
+ /**
60648
+ * UI only property used to track material change for re-render
60649
+ */
60650
+ materialHash?: string;
60578
60651
  };
60579
60652
  isEdited: boolean;
60580
60653
  } | {
@@ -60595,7 +60668,10 @@ export interface ExecutionUnitSchemaForPhysicsBasedSimulationEnginesDefinedUsing
60595
60668
  }[]
60596
60669
  ];
60597
60670
  extraData: {
60598
- materialHash: string;
60671
+ /**
60672
+ * UI only property used to track material change for re-render
60673
+ */
60674
+ materialHash?: string;
60599
60675
  };
60600
60676
  isEdited: boolean;
60601
60677
  } | {
@@ -60632,7 +60708,10 @@ export interface ExecutionUnitSchemaForPhysicsBasedSimulationEnginesDefinedUsing
60632
60708
  hubbardUValue?: number;
60633
60709
  }[];
60634
60710
  extraData: {
60635
- materialHash: string;
60711
+ /**
60712
+ * UI only property used to track material change for re-render
60713
+ */
60714
+ materialHash?: string;
60636
60715
  };
60637
60716
  isEdited: boolean;
60638
60717
  } | {
@@ -60707,7 +60786,10 @@ export interface ExecutionUnitSchemaForPhysicsBasedSimulationEnginesDefinedUsing
60707
60786
  targetFermiEnergy?: number;
60708
60787
  };
60709
60788
  extraData: {
60710
- materialHash: string;
60789
+ /**
60790
+ * UI only property used to track material change for re-render
60791
+ */
60792
+ materialHash?: string;
60711
60793
  };
60712
60794
  isEdited: boolean;
60713
60795
  } | {
@@ -60759,7 +60841,10 @@ export interface ExecutionUnitSchemaForPhysicsBasedSimulationEnginesDefinedUsing
60759
60841
  totalMagnetization: number;
60760
60842
  };
60761
60843
  extraData: {
60762
- materialHash: string;
60844
+ /**
60845
+ * UI only property used to track material change for re-render
60846
+ */
60847
+ materialHash?: string;
60763
60848
  };
60764
60849
  isEdited: boolean;
60765
60850
  } | {
@@ -60797,7 +60882,10 @@ export interface ExecutionUnitSchemaForPhysicsBasedSimulationEnginesDefinedUsing
60797
60882
  };
60798
60883
  };
60799
60884
  extraData: {
60800
- materialHash: string;
60885
+ /**
60886
+ * UI only property used to track material change for re-render
60887
+ */
60888
+ materialHash?: string;
60801
60889
  };
60802
60890
  isEdited: boolean;
60803
60891
  })[];
@@ -61755,7 +61843,10 @@ export interface ExecutionUnitSchemaForScriptingBasedApplications {
61755
61843
  contextProviderName: "vasp-neb";
61756
61844
  };
61757
61845
  extraData: {
61758
- materialHash: string;
61846
+ /**
61847
+ * UI only property used to track material change for re-render
61848
+ */
61849
+ materialHash?: string;
61759
61850
  };
61760
61851
  isEdited: boolean;
61761
61852
  } | {
@@ -61791,7 +61882,10 @@ export interface ExecutionUnitSchemaForScriptingBasedApplications {
61791
61882
  preferGridMetric?: boolean;
61792
61883
  };
61793
61884
  extraData: {
61794
- materialHash: string;
61885
+ /**
61886
+ * UI only property used to track material change for re-render
61887
+ */
61888
+ materialHash?: string;
61795
61889
  };
61796
61890
  isEdited: boolean;
61797
61891
  } | {
@@ -61812,7 +61906,10 @@ export interface ExecutionUnitSchemaForScriptingBasedApplications {
61812
61906
  }[]
61813
61907
  ];
61814
61908
  extraData: {
61815
- materialHash: string;
61909
+ /**
61910
+ * UI only property used to track material change for re-render
61911
+ */
61912
+ materialHash?: string;
61816
61913
  };
61817
61914
  isEdited: boolean;
61818
61915
  } | {
@@ -61849,7 +61946,10 @@ export interface ExecutionUnitSchemaForScriptingBasedApplications {
61849
61946
  hubbardUValue?: number;
61850
61947
  }[];
61851
61948
  extraData: {
61852
- materialHash: string;
61949
+ /**
61950
+ * UI only property used to track material change for re-render
61951
+ */
61952
+ materialHash?: string;
61853
61953
  };
61854
61954
  isEdited: boolean;
61855
61955
  } | {
@@ -61924,7 +62024,10 @@ export interface ExecutionUnitSchemaForScriptingBasedApplications {
61924
62024
  targetFermiEnergy?: number;
61925
62025
  };
61926
62026
  extraData: {
61927
- materialHash: string;
62027
+ /**
62028
+ * UI only property used to track material change for re-render
62029
+ */
62030
+ materialHash?: string;
61928
62031
  };
61929
62032
  isEdited: boolean;
61930
62033
  } | {
@@ -61976,7 +62079,10 @@ export interface ExecutionUnitSchemaForScriptingBasedApplications {
61976
62079
  totalMagnetization: number;
61977
62080
  };
61978
62081
  extraData: {
61979
- materialHash: string;
62082
+ /**
62083
+ * UI only property used to track material change for re-render
62084
+ */
62085
+ materialHash?: string;
61980
62086
  };
61981
62087
  isEdited: boolean;
61982
62088
  } | {
@@ -62014,7 +62120,10 @@ export interface ExecutionUnitSchemaForScriptingBasedApplications {
62014
62120
  };
62015
62121
  };
62016
62122
  extraData: {
62017
- materialHash: string;
62123
+ /**
62124
+ * UI only property used to track material change for re-render
62125
+ */
62126
+ materialHash?: string;
62018
62127
  };
62019
62128
  isEdited: boolean;
62020
62129
  })[];
@@ -63710,7 +63819,10 @@ export interface BaseWorkflowSchema {
63710
63819
  contextProviderName: "vasp-neb";
63711
63820
  };
63712
63821
  extraData: {
63713
- materialHash: string;
63822
+ /**
63823
+ * UI only property used to track material change for re-render
63824
+ */
63825
+ materialHash?: string;
63714
63826
  };
63715
63827
  isEdited: boolean;
63716
63828
  } | {
@@ -63746,7 +63858,10 @@ export interface BaseWorkflowSchema {
63746
63858
  preferGridMetric?: boolean;
63747
63859
  };
63748
63860
  extraData: {
63749
- materialHash: string;
63861
+ /**
63862
+ * UI only property used to track material change for re-render
63863
+ */
63864
+ materialHash?: string;
63750
63865
  };
63751
63866
  isEdited: boolean;
63752
63867
  } | {
@@ -63767,7 +63882,10 @@ export interface BaseWorkflowSchema {
63767
63882
  }[]
63768
63883
  ];
63769
63884
  extraData: {
63770
- materialHash: string;
63885
+ /**
63886
+ * UI only property used to track material change for re-render
63887
+ */
63888
+ materialHash?: string;
63771
63889
  };
63772
63890
  isEdited: boolean;
63773
63891
  } | {
@@ -63804,7 +63922,10 @@ export interface BaseWorkflowSchema {
63804
63922
  hubbardUValue?: number;
63805
63923
  }[];
63806
63924
  extraData: {
63807
- materialHash: string;
63925
+ /**
63926
+ * UI only property used to track material change for re-render
63927
+ */
63928
+ materialHash?: string;
63808
63929
  };
63809
63930
  isEdited: boolean;
63810
63931
  } | {
@@ -63879,7 +64000,10 @@ export interface BaseWorkflowSchema {
63879
64000
  targetFermiEnergy?: number;
63880
64001
  };
63881
64002
  extraData: {
63882
- materialHash: string;
64003
+ /**
64004
+ * UI only property used to track material change for re-render
64005
+ */
64006
+ materialHash?: string;
63883
64007
  };
63884
64008
  isEdited: boolean;
63885
64009
  } | {
@@ -63931,7 +64055,10 @@ export interface BaseWorkflowSchema {
63931
64055
  totalMagnetization: number;
63932
64056
  };
63933
64057
  extraData: {
63934
- materialHash: string;
64058
+ /**
64059
+ * UI only property used to track material change for re-render
64060
+ */
64061
+ materialHash?: string;
63935
64062
  };
63936
64063
  isEdited: boolean;
63937
64064
  } | {
@@ -63969,7 +64096,10 @@ export interface BaseWorkflowSchema {
63969
64096
  };
63970
64097
  };
63971
64098
  extraData: {
63972
- materialHash: string;
64099
+ /**
64100
+ * UI only property used to track material change for re-render
64101
+ */
64102
+ materialHash?: string;
63973
64103
  };
63974
64104
  isEdited: boolean;
63975
64105
  })[];
@@ -65924,7 +66054,10 @@ export interface SubworkflowMixinSchema {
65924
66054
  contextProviderName: "vasp-neb";
65925
66055
  };
65926
66056
  extraData: {
65927
- materialHash: string;
66057
+ /**
66058
+ * UI only property used to track material change for re-render
66059
+ */
66060
+ materialHash?: string;
65928
66061
  };
65929
66062
  isEdited: boolean;
65930
66063
  } | {
@@ -65960,7 +66093,10 @@ export interface SubworkflowMixinSchema {
65960
66093
  preferGridMetric?: boolean;
65961
66094
  };
65962
66095
  extraData: {
65963
- materialHash: string;
66096
+ /**
66097
+ * UI only property used to track material change for re-render
66098
+ */
66099
+ materialHash?: string;
65964
66100
  };
65965
66101
  isEdited: boolean;
65966
66102
  } | {
@@ -65981,7 +66117,10 @@ export interface SubworkflowMixinSchema {
65981
66117
  }[]
65982
66118
  ];
65983
66119
  extraData: {
65984
- materialHash: string;
66120
+ /**
66121
+ * UI only property used to track material change for re-render
66122
+ */
66123
+ materialHash?: string;
65985
66124
  };
65986
66125
  isEdited: boolean;
65987
66126
  } | {
@@ -66018,7 +66157,10 @@ export interface SubworkflowMixinSchema {
66018
66157
  hubbardUValue?: number;
66019
66158
  }[];
66020
66159
  extraData: {
66021
- materialHash: string;
66160
+ /**
66161
+ * UI only property used to track material change for re-render
66162
+ */
66163
+ materialHash?: string;
66022
66164
  };
66023
66165
  isEdited: boolean;
66024
66166
  } | {
@@ -66093,7 +66235,10 @@ export interface SubworkflowMixinSchema {
66093
66235
  targetFermiEnergy?: number;
66094
66236
  };
66095
66237
  extraData: {
66096
- materialHash: string;
66238
+ /**
66239
+ * UI only property used to track material change for re-render
66240
+ */
66241
+ materialHash?: string;
66097
66242
  };
66098
66243
  isEdited: boolean;
66099
66244
  } | {
@@ -66145,7 +66290,10 @@ export interface SubworkflowMixinSchema {
66145
66290
  totalMagnetization: number;
66146
66291
  };
66147
66292
  extraData: {
66148
- materialHash: string;
66293
+ /**
66294
+ * UI only property used to track material change for re-render
66295
+ */
66296
+ materialHash?: string;
66149
66297
  };
66150
66298
  isEdited: boolean;
66151
66299
  } | {
@@ -66183,7 +66331,10 @@ export interface SubworkflowMixinSchema {
66183
66331
  };
66184
66332
  };
66185
66333
  extraData: {
66186
- materialHash: string;
66334
+ /**
66335
+ * UI only property used to track material change for re-render
66336
+ */
66337
+ materialHash?: string;
66187
66338
  };
66188
66339
  isEdited: boolean;
66189
66340
  })[];
@@ -67536,7 +67687,10 @@ export type WorkflowSubworkflowUnitSchema = {
67536
67687
  contextProviderName: "vasp-neb";
67537
67688
  };
67538
67689
  extraData: {
67539
- materialHash: string;
67690
+ /**
67691
+ * UI only property used to track material change for re-render
67692
+ */
67693
+ materialHash?: string;
67540
67694
  };
67541
67695
  isEdited: boolean;
67542
67696
  } | {
@@ -67572,7 +67726,10 @@ export type WorkflowSubworkflowUnitSchema = {
67572
67726
  preferGridMetric?: boolean;
67573
67727
  };
67574
67728
  extraData: {
67575
- materialHash: string;
67729
+ /**
67730
+ * UI only property used to track material change for re-render
67731
+ */
67732
+ materialHash?: string;
67576
67733
  };
67577
67734
  isEdited: boolean;
67578
67735
  } | {
@@ -67593,7 +67750,10 @@ export type WorkflowSubworkflowUnitSchema = {
67593
67750
  }[]
67594
67751
  ];
67595
67752
  extraData: {
67596
- materialHash: string;
67753
+ /**
67754
+ * UI only property used to track material change for re-render
67755
+ */
67756
+ materialHash?: string;
67597
67757
  };
67598
67758
  isEdited: boolean;
67599
67759
  } | {
@@ -67630,7 +67790,10 @@ export type WorkflowSubworkflowUnitSchema = {
67630
67790
  hubbardUValue?: number;
67631
67791
  }[];
67632
67792
  extraData: {
67633
- materialHash: string;
67793
+ /**
67794
+ * UI only property used to track material change for re-render
67795
+ */
67796
+ materialHash?: string;
67634
67797
  };
67635
67798
  isEdited: boolean;
67636
67799
  } | {
@@ -67705,7 +67868,10 @@ export type WorkflowSubworkflowUnitSchema = {
67705
67868
  targetFermiEnergy?: number;
67706
67869
  };
67707
67870
  extraData: {
67708
- materialHash: string;
67871
+ /**
67872
+ * UI only property used to track material change for re-render
67873
+ */
67874
+ materialHash?: string;
67709
67875
  };
67710
67876
  isEdited: boolean;
67711
67877
  } | {
@@ -67757,7 +67923,10 @@ export type WorkflowSubworkflowUnitSchema = {
67757
67923
  totalMagnetization: number;
67758
67924
  };
67759
67925
  extraData: {
67760
- materialHash: string;
67926
+ /**
67927
+ * UI only property used to track material change for re-render
67928
+ */
67929
+ materialHash?: string;
67761
67930
  };
67762
67931
  isEdited: boolean;
67763
67932
  } | {
@@ -67795,7 +67964,10 @@ export type WorkflowSubworkflowUnitSchema = {
67795
67964
  };
67796
67965
  };
67797
67966
  extraData: {
67798
- materialHash: string;
67967
+ /**
67968
+ * UI only property used to track material change for re-render
67969
+ */
67970
+ materialHash?: string;
67799
67971
  };
67800
67972
  isEdited: boolean;
67801
67973
  })[];
@@ -69079,7 +69251,10 @@ export interface SubworkflowSchema {
69079
69251
  contextProviderName: "vasp-neb";
69080
69252
  };
69081
69253
  extraData: {
69082
- materialHash: string;
69254
+ /**
69255
+ * UI only property used to track material change for re-render
69256
+ */
69257
+ materialHash?: string;
69083
69258
  };
69084
69259
  isEdited: boolean;
69085
69260
  } | {
@@ -69115,7 +69290,10 @@ export interface SubworkflowSchema {
69115
69290
  preferGridMetric?: boolean;
69116
69291
  };
69117
69292
  extraData: {
69118
- materialHash: string;
69293
+ /**
69294
+ * UI only property used to track material change for re-render
69295
+ */
69296
+ materialHash?: string;
69119
69297
  };
69120
69298
  isEdited: boolean;
69121
69299
  } | {
@@ -69136,7 +69314,10 @@ export interface SubworkflowSchema {
69136
69314
  }[]
69137
69315
  ];
69138
69316
  extraData: {
69139
- materialHash: string;
69317
+ /**
69318
+ * UI only property used to track material change for re-render
69319
+ */
69320
+ materialHash?: string;
69140
69321
  };
69141
69322
  isEdited: boolean;
69142
69323
  } | {
@@ -69173,7 +69354,10 @@ export interface SubworkflowSchema {
69173
69354
  hubbardUValue?: number;
69174
69355
  }[];
69175
69356
  extraData: {
69176
- materialHash: string;
69357
+ /**
69358
+ * UI only property used to track material change for re-render
69359
+ */
69360
+ materialHash?: string;
69177
69361
  };
69178
69362
  isEdited: boolean;
69179
69363
  } | {
@@ -69248,7 +69432,10 @@ export interface SubworkflowSchema {
69248
69432
  targetFermiEnergy?: number;
69249
69433
  };
69250
69434
  extraData: {
69251
- materialHash: string;
69435
+ /**
69436
+ * UI only property used to track material change for re-render
69437
+ */
69438
+ materialHash?: string;
69252
69439
  };
69253
69440
  isEdited: boolean;
69254
69441
  } | {
@@ -69300,7 +69487,10 @@ export interface SubworkflowSchema {
69300
69487
  totalMagnetization: number;
69301
69488
  };
69302
69489
  extraData: {
69303
- materialHash: string;
69490
+ /**
69491
+ * UI only property used to track material change for re-render
69492
+ */
69493
+ materialHash?: string;
69304
69494
  };
69305
69495
  isEdited: boolean;
69306
69496
  } | {
@@ -69338,7 +69528,10 @@ export interface SubworkflowSchema {
69338
69528
  };
69339
69529
  };
69340
69530
  extraData: {
69341
- materialHash: string;
69531
+ /**
69532
+ * UI only property used to track material change for re-render
69533
+ */
69534
+ materialHash?: string;
69342
69535
  };
69343
69536
  isEdited: boolean;
69344
69537
  })[];
@@ -70121,7 +70314,10 @@ export interface BaseContextItemSchema {
70121
70314
  }
70122
70315
  /** Schema dist/js/schema/workflow/unit/context/_extra_data_material_hash.json */
70123
70316
  export interface ExtraDataWithMaterialHashSchema {
70124
- materialHash: string;
70317
+ /**
70318
+ * UI only property used to track material change for re-render
70319
+ */
70320
+ materialHash?: string;
70125
70321
  }
70126
70322
  /** Schema dist/js/schema/workflow/unit/context/item/boundaryConditions.json */
70127
70323
  export interface BoundaryConditionsContextItemSchema {
@@ -70136,7 +70332,10 @@ export interface BoundaryConditionsContextItemSchema {
70136
70332
  targetFermiEnergy?: number;
70137
70333
  };
70138
70334
  extraData: {
70139
- materialHash: string;
70335
+ /**
70336
+ * UI only property used to track material change for re-render
70337
+ */
70338
+ materialHash?: string;
70140
70339
  };
70141
70340
  isEdited: boolean;
70142
70341
  }
@@ -70156,7 +70355,10 @@ export interface CollinearMagnetizationContextItemSchema {
70156
70355
  totalMagnetization: number;
70157
70356
  };
70158
70357
  extraData: {
70159
- materialHash: string;
70358
+ /**
70359
+ * UI only property used to track material change for re-render
70360
+ */
70361
+ materialHash?: string;
70160
70362
  };
70161
70363
  isEdited: boolean;
70162
70364
  }
@@ -70211,7 +70413,10 @@ export interface GridContextItemSchema {
70211
70413
  preferGridMetric?: boolean;
70212
70414
  };
70213
70415
  extraData: {
70214
- materialHash: string;
70416
+ /**
70417
+ * UI only property used to track material change for re-render
70418
+ */
70419
+ materialHash?: string;
70215
70420
  };
70216
70421
  isEdited: boolean;
70217
70422
  }
@@ -70275,7 +70480,10 @@ export interface HubbardUContextItemSchema {
70275
70480
  hubbardUValue?: number;
70276
70481
  }[];
70277
70482
  extraData: {
70278
- materialHash: string;
70483
+ /**
70484
+ * UI only property used to track material change for re-render
70485
+ */
70486
+ materialHash?: string;
70279
70487
  };
70280
70488
  isEdited: boolean;
70281
70489
  }
@@ -70634,7 +70842,10 @@ export interface InputContextItemSchema {
70634
70842
  contextProviderName: "vasp-neb";
70635
70843
  };
70636
70844
  extraData: {
70637
- materialHash: string;
70845
+ /**
70846
+ * UI only property used to track material change for re-render
70847
+ */
70848
+ materialHash?: string;
70638
70849
  };
70639
70850
  isEdited: boolean;
70640
70851
  }
@@ -70711,7 +70922,10 @@ export interface NonCollinearMagnetizationContextItemSchema {
70711
70922
  };
70712
70923
  };
70713
70924
  extraData: {
70714
- materialHash: string;
70925
+ /**
70926
+ * UI only property used to track material change for re-render
70927
+ */
70928
+ materialHash?: string;
70715
70929
  };
70716
70930
  isEdited: boolean;
70717
70931
  }
@@ -70734,7 +70948,10 @@ export interface PathContextItemSchema {
70734
70948
  }[]
70735
70949
  ];
70736
70950
  extraData: {
70737
- materialHash: string;
70951
+ /**
70952
+ * UI only property used to track material change for re-render
70953
+ */
70954
+ materialHash?: string;
70738
70955
  };
70739
70956
  isEdited: boolean;
70740
70957
  }
@@ -71062,7 +71279,10 @@ export type ContextItemSchema = {
71062
71279
  contextProviderName: "vasp-neb";
71063
71280
  };
71064
71281
  extraData: {
71065
- materialHash: string;
71282
+ /**
71283
+ * UI only property used to track material change for re-render
71284
+ */
71285
+ materialHash?: string;
71066
71286
  };
71067
71287
  isEdited: boolean;
71068
71288
  } | {
@@ -71098,7 +71318,10 @@ export type ContextItemSchema = {
71098
71318
  preferGridMetric?: boolean;
71099
71319
  };
71100
71320
  extraData: {
71101
- materialHash: string;
71321
+ /**
71322
+ * UI only property used to track material change for re-render
71323
+ */
71324
+ materialHash?: string;
71102
71325
  };
71103
71326
  isEdited: boolean;
71104
71327
  } | {
@@ -71119,7 +71342,10 @@ export type ContextItemSchema = {
71119
71342
  }[]
71120
71343
  ];
71121
71344
  extraData: {
71122
- materialHash: string;
71345
+ /**
71346
+ * UI only property used to track material change for re-render
71347
+ */
71348
+ materialHash?: string;
71123
71349
  };
71124
71350
  isEdited: boolean;
71125
71351
  } | {
@@ -71156,7 +71382,10 @@ export type ContextItemSchema = {
71156
71382
  hubbardUValue?: number;
71157
71383
  }[];
71158
71384
  extraData: {
71159
- materialHash: string;
71385
+ /**
71386
+ * UI only property used to track material change for re-render
71387
+ */
71388
+ materialHash?: string;
71160
71389
  };
71161
71390
  isEdited: boolean;
71162
71391
  } | {
@@ -71231,7 +71460,10 @@ export type ContextItemSchema = {
71231
71460
  targetFermiEnergy?: number;
71232
71461
  };
71233
71462
  extraData: {
71234
- materialHash: string;
71463
+ /**
71464
+ * UI only property used to track material change for re-render
71465
+ */
71466
+ materialHash?: string;
71235
71467
  };
71236
71468
  isEdited: boolean;
71237
71469
  } | {
@@ -71283,7 +71515,10 @@ export type ContextItemSchema = {
71283
71515
  totalMagnetization: number;
71284
71516
  };
71285
71517
  extraData: {
71286
- materialHash: string;
71518
+ /**
71519
+ * UI only property used to track material change for re-render
71520
+ */
71521
+ materialHash?: string;
71287
71522
  };
71288
71523
  isEdited: boolean;
71289
71524
  } | {
@@ -71321,7 +71556,10 @@ export type ContextItemSchema = {
71321
71556
  };
71322
71557
  };
71323
71558
  extraData: {
71324
- materialHash: string;
71559
+ /**
71560
+ * UI only property used to track material change for re-render
71561
+ */
71562
+ materialHash?: string;
71325
71563
  };
71326
71564
  isEdited: boolean;
71327
71565
  };
@@ -71967,7 +72205,10 @@ export interface ExecutionUnitSchema {
71967
72205
  contextProviderName: "vasp-neb";
71968
72206
  };
71969
72207
  extraData: {
71970
- materialHash: string;
72208
+ /**
72209
+ * UI only property used to track material change for re-render
72210
+ */
72211
+ materialHash?: string;
71971
72212
  };
71972
72213
  isEdited: boolean;
71973
72214
  } | {
@@ -72003,7 +72244,10 @@ export interface ExecutionUnitSchema {
72003
72244
  preferGridMetric?: boolean;
72004
72245
  };
72005
72246
  extraData: {
72006
- materialHash: string;
72247
+ /**
72248
+ * UI only property used to track material change for re-render
72249
+ */
72250
+ materialHash?: string;
72007
72251
  };
72008
72252
  isEdited: boolean;
72009
72253
  } | {
@@ -72024,7 +72268,10 @@ export interface ExecutionUnitSchema {
72024
72268
  }[]
72025
72269
  ];
72026
72270
  extraData: {
72027
- materialHash: string;
72271
+ /**
72272
+ * UI only property used to track material change for re-render
72273
+ */
72274
+ materialHash?: string;
72028
72275
  };
72029
72276
  isEdited: boolean;
72030
72277
  } | {
@@ -72061,7 +72308,10 @@ export interface ExecutionUnitSchema {
72061
72308
  hubbardUValue?: number;
72062
72309
  }[];
72063
72310
  extraData: {
72064
- materialHash: string;
72311
+ /**
72312
+ * UI only property used to track material change for re-render
72313
+ */
72314
+ materialHash?: string;
72065
72315
  };
72066
72316
  isEdited: boolean;
72067
72317
  } | {
@@ -72136,7 +72386,10 @@ export interface ExecutionUnitSchema {
72136
72386
  targetFermiEnergy?: number;
72137
72387
  };
72138
72388
  extraData: {
72139
- materialHash: string;
72389
+ /**
72390
+ * UI only property used to track material change for re-render
72391
+ */
72392
+ materialHash?: string;
72140
72393
  };
72141
72394
  isEdited: boolean;
72142
72395
  } | {
@@ -72188,7 +72441,10 @@ export interface ExecutionUnitSchema {
72188
72441
  totalMagnetization: number;
72189
72442
  };
72190
72443
  extraData: {
72191
- materialHash: string;
72444
+ /**
72445
+ * UI only property used to track material change for re-render
72446
+ */
72447
+ materialHash?: string;
72192
72448
  };
72193
72449
  isEdited: boolean;
72194
72450
  } | {
@@ -72226,7 +72482,10 @@ export interface ExecutionUnitSchema {
72226
72482
  };
72227
72483
  };
72228
72484
  extraData: {
72229
- materialHash: string;
72485
+ /**
72486
+ * UI only property used to track material change for re-render
72487
+ */
72488
+ materialHash?: string;
72230
72489
  };
72231
72490
  isEdited: boolean;
72232
72491
  })[];
@@ -73365,7 +73624,10 @@ export interface ExecutionUnitMixinSchema {
73365
73624
  contextProviderName: "vasp-neb";
73366
73625
  };
73367
73626
  extraData: {
73368
- materialHash: string;
73627
+ /**
73628
+ * UI only property used to track material change for re-render
73629
+ */
73630
+ materialHash?: string;
73369
73631
  };
73370
73632
  isEdited: boolean;
73371
73633
  } | {
@@ -73401,7 +73663,10 @@ export interface ExecutionUnitMixinSchema {
73401
73663
  preferGridMetric?: boolean;
73402
73664
  };
73403
73665
  extraData: {
73404
- materialHash: string;
73666
+ /**
73667
+ * UI only property used to track material change for re-render
73668
+ */
73669
+ materialHash?: string;
73405
73670
  };
73406
73671
  isEdited: boolean;
73407
73672
  } | {
@@ -73422,7 +73687,10 @@ export interface ExecutionUnitMixinSchema {
73422
73687
  }[]
73423
73688
  ];
73424
73689
  extraData: {
73425
- materialHash: string;
73690
+ /**
73691
+ * UI only property used to track material change for re-render
73692
+ */
73693
+ materialHash?: string;
73426
73694
  };
73427
73695
  isEdited: boolean;
73428
73696
  } | {
@@ -73459,7 +73727,10 @@ export interface ExecutionUnitMixinSchema {
73459
73727
  hubbardUValue?: number;
73460
73728
  }[];
73461
73729
  extraData: {
73462
- materialHash: string;
73730
+ /**
73731
+ * UI only property used to track material change for re-render
73732
+ */
73733
+ materialHash?: string;
73463
73734
  };
73464
73735
  isEdited: boolean;
73465
73736
  } | {
@@ -73534,7 +73805,10 @@ export interface ExecutionUnitMixinSchema {
73534
73805
  targetFermiEnergy?: number;
73535
73806
  };
73536
73807
  extraData: {
73537
- materialHash: string;
73808
+ /**
73809
+ * UI only property used to track material change for re-render
73810
+ */
73811
+ materialHash?: string;
73538
73812
  };
73539
73813
  isEdited: boolean;
73540
73814
  } | {
@@ -73586,7 +73860,10 @@ export interface ExecutionUnitMixinSchema {
73586
73860
  totalMagnetization: number;
73587
73861
  };
73588
73862
  extraData: {
73589
- materialHash: string;
73863
+ /**
73864
+ * UI only property used to track material change for re-render
73865
+ */
73866
+ materialHash?: string;
73590
73867
  };
73591
73868
  isEdited: boolean;
73592
73869
  } | {
@@ -73624,7 +73901,10 @@ export interface ExecutionUnitMixinSchema {
73624
73901
  };
73625
73902
  };
73626
73903
  extraData: {
73627
- materialHash: string;
73904
+ /**
73905
+ * UI only property used to track material change for re-render
73906
+ */
73907
+ materialHash?: string;
73628
73908
  };
73629
73909
  isEdited: boolean;
73630
73910
  })[];
@@ -75687,7 +75967,10 @@ export interface WorkflowSchema {
75687
75967
  contextProviderName: "vasp-neb";
75688
75968
  };
75689
75969
  extraData: {
75690
- materialHash: string;
75970
+ /**
75971
+ * UI only property used to track material change for re-render
75972
+ */
75973
+ materialHash?: string;
75691
75974
  };
75692
75975
  isEdited: boolean;
75693
75976
  } | {
@@ -75723,7 +76006,10 @@ export interface WorkflowSchema {
75723
76006
  preferGridMetric?: boolean;
75724
76007
  };
75725
76008
  extraData: {
75726
- materialHash: string;
76009
+ /**
76010
+ * UI only property used to track material change for re-render
76011
+ */
76012
+ materialHash?: string;
75727
76013
  };
75728
76014
  isEdited: boolean;
75729
76015
  } | {
@@ -75744,7 +76030,10 @@ export interface WorkflowSchema {
75744
76030
  }[]
75745
76031
  ];
75746
76032
  extraData: {
75747
- materialHash: string;
76033
+ /**
76034
+ * UI only property used to track material change for re-render
76035
+ */
76036
+ materialHash?: string;
75748
76037
  };
75749
76038
  isEdited: boolean;
75750
76039
  } | {
@@ -75781,7 +76070,10 @@ export interface WorkflowSchema {
75781
76070
  hubbardUValue?: number;
75782
76071
  }[];
75783
76072
  extraData: {
75784
- materialHash: string;
76073
+ /**
76074
+ * UI only property used to track material change for re-render
76075
+ */
76076
+ materialHash?: string;
75785
76077
  };
75786
76078
  isEdited: boolean;
75787
76079
  } | {
@@ -75856,7 +76148,10 @@ export interface WorkflowSchema {
75856
76148
  targetFermiEnergy?: number;
75857
76149
  };
75858
76150
  extraData: {
75859
- materialHash: string;
76151
+ /**
76152
+ * UI only property used to track material change for re-render
76153
+ */
76154
+ materialHash?: string;
75860
76155
  };
75861
76156
  isEdited: boolean;
75862
76157
  } | {
@@ -75908,7 +76203,10 @@ export interface WorkflowSchema {
75908
76203
  totalMagnetization: number;
75909
76204
  };
75910
76205
  extraData: {
75911
- materialHash: string;
76206
+ /**
76207
+ * UI only property used to track material change for re-render
76208
+ */
76209
+ materialHash?: string;
75912
76210
  };
75913
76211
  isEdited: boolean;
75914
76212
  } | {
@@ -75946,7 +76244,10 @@ export interface WorkflowSchema {
75946
76244
  };
75947
76245
  };
75948
76246
  extraData: {
75949
- materialHash: string;
76247
+ /**
76248
+ * UI only property used to track material change for re-render
76249
+ */
76250
+ materialHash?: string;
75950
76251
  };
75951
76252
  isEdited: boolean;
75952
76253
  })[];