@mat3ra/esse 2026.5.18-2 → 2026.5.27-0

package/dist/js/schema/models_directory/legacy/any.json

@@ -0,0 +1,488 @@
+{
+    "$id": "models-directory/legacy/any",
+    "$schema": "http://json-schema.org/draft-07/schema#",
+    "title": "Any model schema",
+    "type": "object",
+    "oneOf": [
+        {
+            "$schema": "http://json-schema.org/draft-07/schema#",
+            "title": "DFT model schema",
+            "type": "object",
+            "definitions": {
+                "lda": {
+                    "required": [
+                        "type",
+                        "subtype",
+                        "functional",
+                        "method"
+                    ],
+                    "properties": {
+                        "type": {
+                            "const": "dft"
+                        },
+                        "subtype": {
+                            "const": "lda"
+                        },
+                        "functional": {
+                            "enum": [
+                                "pz",
+                                "pw",
+                                "vwn",
+                                "other"
+                            ]
+                        },
+                        "method": {
+                            "$schema": "http://json-schema.org/draft-07/schema#",
+                            "title": "base method",
+                            "type": "object",
+                            "required": [
+                                "type",
+                                "subtype"
+                            ],
+                            "properties": {
+                                "type": {
+                                    "description": "general type of this method, eg. `pseudopotential`",
+                                    "type": "string"
+                                },
+                                "subtype": {
+                                    "description": "general subtype of this method, eg. `ultra-soft`",
+                                    "type": "string"
+                                },
+                                "precision": {
+                                    "description": "Object showing the actual possible precision based on theory and implementation",
+                                    "type": "object"
+                                },
+                                "data": {
+                                    "description": "additional data specific to method, eg. array of pseudopotentials",
+                                    "type": "object",
+                                    "additionalProperties": true,
+                                    "properties": {
+                                        "searchText": {
+                                            "type": "string"
+                                        }
+                                    }
+                                }
+                            }
+                        }
+                    }
+                },
+                "gga": {
+                    "required": [
+                        "type",
+                        "subtype",
+                        "functional",
+                        "method"
+                    ],
+                    "properties": {
+                        "type": {
+                            "const": "dft"
+                        },
+                        "subtype": {
+                            "const": "gga"
+                        },
+                        "functional": {
+                            "enum": [
+                                "pbe",
+                                "pbesol",
+                                "pw91",
+                                "other"
+                            ]
+                        },
+                        "method": {
+                            "$schema": "http://json-schema.org/draft-07/schema#",
+                            "title": "base method",
+                            "type": "object",
+                            "required": [
+                                "type",
+                                "subtype"
+                            ],
+                            "properties": {
+                                "type": {
+                                    "description": "general type of this method, eg. `pseudopotential`",
+                                    "type": "string"
+                                },
+                                "subtype": {
+                                    "description": "general subtype of this method, eg. `ultra-soft`",
+                                    "type": "string"
+                                },
+                                "precision": {
+                                    "description": "Object showing the actual possible precision based on theory and implementation",
+                                    "type": "object"
+                                },
+                                "data": {
+                                    "description": "additional data specific to method, eg. array of pseudopotentials",
+                                    "type": "object",
+                                    "additionalProperties": true,
+                                    "properties": {
+                                        "searchText": {
+                                            "type": "string"
+                                        }
+                                    }
+                                }
+                            }
+                        }
+                    }
+                },
+                "hybrid": {
+                    "required": [
+                        "type",
+                        "subtype",
+                        "functional",
+                        "method"
+                    ],
+                    "properties": {
+                        "type": {
+                            "const": "dft"
+                        },
+                        "subtype": {
+                            "const": "hybrid"
+                        },
+                        "functional": {
+                            "enum": [
+                                "b3lyp",
+                                "hse06"
+                            ]
+                        },
+                        "method": {
+                            "$schema": "http://json-schema.org/draft-07/schema#",
+                            "title": "base method",
+                            "type": "object",
+                            "required": [
+                                "type",
+                                "subtype"
+                            ],
+                            "properties": {
+                                "type": {
+                                    "description": "general type of this method, eg. `pseudopotential`",
+                                    "type": "string"
+                                },
+                                "subtype": {
+                                    "description": "general subtype of this method, eg. `ultra-soft`",
+                                    "type": "string"
+                                },
+                                "precision": {
+                                    "description": "Object showing the actual possible precision based on theory and implementation",
+                                    "type": "object"
+                                },
+                                "data": {
+                                    "description": "additional data specific to method, eg. array of pseudopotentials",
+                                    "type": "object",
+                                    "additionalProperties": true,
+                                    "properties": {
+                                        "searchText": {
+                                            "type": "string"
+                                        }
+                                    }
+                                }
+                            }
+                        }
+                    }
+                }
+            },
+            "oneOf": [
+                {
+                    "properties": {
+                        "type": {
+                            "const": "dft"
+                        },
+                        "subtype": {
+                            "const": "lda"
+                        },
+                        "functional": {
+                            "enum": [
+                                "pz",
+                                "pw",
+                                "vwn",
+                                "other"
+                            ]
+                        },
+                        "method": {
+                            "$schema": "http://json-schema.org/draft-07/schema#",
+                            "title": "base method",
+                            "type": "object",
+                            "required": [
+                                "type",
+                                "subtype"
+                            ],
+                            "properties": {
+                                "type": {
+                                    "description": "general type of this method, eg. `pseudopotential`",
+                                    "type": "string"
+                                },
+                                "subtype": {
+                                    "description": "general subtype of this method, eg. `ultra-soft`",
+                                    "type": "string"
+                                },
+                                "precision": {
+                                    "description": "Object showing the actual possible precision based on theory and implementation",
+                                    "type": "object"
+                                },
+                                "data": {
+                                    "description": "additional data specific to method, eg. array of pseudopotentials",
+                                    "type": "object",
+                                    "additionalProperties": true,
+                                    "properties": {
+                                        "searchText": {
+                                            "type": "string"
+                                        }
+                                    }
+                                }
+                            }
+                        }
+                    },
+                    "required": [
+                        "type",
+                        "subtype",
+                        "functional",
+                        "method"
+                    ]
+                },
+                {
+                    "properties": {
+                        "type": {
+                            "const": "dft"
+                        },
+                        "subtype": {
+                            "const": "gga"
+                        },
+                        "functional": {
+                            "enum": [
+                                "pbe",
+                                "pbesol",
+                                "pw91",
+                                "other"
+                            ]
+                        },
+                        "method": {
+                            "$schema": "http://json-schema.org/draft-07/schema#",
+                            "title": "base method",
+                            "type": "object",
+                            "required": [
+                                "type",
+                                "subtype"
+                            ],
+                            "properties": {
+                                "type": {
+                                    "description": "general type of this method, eg. `pseudopotential`",
+                                    "type": "string"
+                                },
+                                "subtype": {
+                                    "description": "general subtype of this method, eg. `ultra-soft`",
+                                    "type": "string"
+                                },
+                                "precision": {
+                                    "description": "Object showing the actual possible precision based on theory and implementation",
+                                    "type": "object"
+                                },
+                                "data": {
+                                    "description": "additional data specific to method, eg. array of pseudopotentials",
+                                    "type": "object",
+                                    "additionalProperties": true,
+                                    "properties": {
+                                        "searchText": {
+                                            "type": "string"
+                                        }
+                                    }
+                                }
+                            }
+                        }
+                    },
+                    "required": [
+                        "type",
+                        "subtype",
+                        "functional",
+                        "method"
+                    ]
+                },
+                {
+                    "properties": {
+                        "type": {
+                            "const": "dft"
+                        },
+                        "subtype": {
+                            "const": "hybrid"
+                        },
+                        "functional": {
+                            "enum": [
+                                "b3lyp",
+                                "hse06"
+                            ]
+                        },
+                        "method": {
+                            "$schema": "http://json-schema.org/draft-07/schema#",
+                            "title": "base method",
+                            "type": "object",
+                            "required": [
+                                "type",
+                                "subtype"
+                            ],
+                            "properties": {
+                                "type": {
+                                    "description": "general type of this method, eg. `pseudopotential`",
+                                    "type": "string"
+                                },
+                                "subtype": {
+                                    "description": "general subtype of this method, eg. `ultra-soft`",
+                                    "type": "string"
+                                },
+                                "precision": {
+                                    "description": "Object showing the actual possible precision based on theory and implementation",
+                                    "type": "object"
+                                },
+                                "data": {
+                                    "description": "additional data specific to method, eg. array of pseudopotentials",
+                                    "type": "object",
+                                    "additionalProperties": true,
+                                    "properties": {
+                                        "searchText": {
+                                            "type": "string"
+                                        }
+                                    }
+                                }
+                            }
+                        }
+                    },
+                    "required": [
+                        "type",
+                        "subtype",
+                        "functional",
+                        "method"
+                    ]
+                }
+            ],
+            "discriminator": {
+                "propertyName": "subtype"
+            },
+            "required": [
+                "type"
+            ],
+            "properties": {
+                "type": {
+                    "const": "dft"
+                },
+                "subtype": {
+                    "type": "string"
+                },
+                "functional": {
+                    "type": "string"
+                },
+                "method": {
+                    "type": "object"
+                }
+            }
+        },
+        {
+            "$schema": "http://json-schema.org/draft-07/schema#",
+            "title": "ML model schema",
+            "type": "object",
+            "properties": {
+                "type": {
+                    "enum": [
+                        "ml"
+                    ]
+                },
+                "subtype": {
+                    "enum": [
+                        "re"
+                    ]
+                },
+                "method": {
+                    "$schema": "http://json-schema.org/draft-07/schema#",
+                    "title": "base method",
+                    "type": "object",
+                    "required": [
+                        "type",
+                        "subtype"
+                    ],
+                    "properties": {
+                        "type": {
+                            "description": "general type of this method, eg. `pseudopotential`",
+                            "type": "string"
+                        },
+                        "subtype": {
+                            "description": "general subtype of this method, eg. `ultra-soft`",
+                            "type": "string"
+                        },
+                        "precision": {
+                            "description": "Object showing the actual possible precision based on theory and implementation",
+                            "type": "object"
+                        },
+                        "data": {
+                            "description": "additional data specific to method, eg. array of pseudopotentials",
+                            "type": "object",
+                            "additionalProperties": true,
+                            "properties": {
+                                "searchText": {
+                                    "type": "string"
+                                }
+                            }
+                        }
+                    }
+                }
+            },
+            "required": [
+                "type",
+                "subtype",
+                "method"
+            ]
+        },
+        {
+            "$schema": "http://json-schema.org/draft-07/schema#",
+            "title": "Unknown model schema",
+            "type": "object",
+            "properties": {
+                "type": {
+                    "enum": [
+                        "unknown"
+                    ]
+                },
+                "subtype": {
+                    "enum": [
+                        "unknown"
+                    ]
+                },
+                "method": {
+                    "$schema": "http://json-schema.org/draft-07/schema#",
+                    "title": "base method",
+                    "type": "object",
+                    "required": [
+                        "type",
+                        "subtype"
+                    ],
+                    "properties": {
+                        "type": {
+                            "description": "general type of this method, eg. `pseudopotential`",
+                            "type": "string"
+                        },
+                        "subtype": {
+                            "description": "general subtype of this method, eg. `ultra-soft`",
+                            "type": "string"
+                        },
+                        "precision": {
+                            "description": "Object showing the actual possible precision based on theory and implementation",
+                            "type": "object"
+                        },
+                        "data": {
+                            "description": "additional data specific to method, eg. array of pseudopotentials",
+                            "type": "object",
+                            "additionalProperties": true,
+                            "properties": {
+                                "searchText": {
+                                    "type": "string"
+                                }
+                            }
+                        }
+                    }
+                }
+            },
+            "required": [
+                "type",
+                "subtype",
+                "method"
+            ]
+        }
+    ],
+    "discriminator": {
+        "propertyName": "type"
+    }
+}