Technische Prüfungen & Formate
F TD2000 GEO INDUSTRY B008 / triclinic reciprocal lattice bragg complex structure factor
Compute declared crystallographic reflection geometry and complex scattering amplitudes.
POST https://detect.halowerk.com/v1/F-TD2000-GEO-INDUSTRY-B008/triclinic-reciprocal-lattice-bragg-complex-structure-factorEingaben
| Feld | Typ | Pflicht | Beschreibung |
|---|---|---|---|
| artifact | object | Ja |
Vollständiges Eingabeschema anzeigen
{
"type": "object",
"additionalProperties": false,
"required": [
"artifact"
],
"properties": {
"artifact": {
"type": "object",
"additionalProperties": false,
"required": [
"crystal"
],
"properties": {
"crystal": {
"type": "object",
"additionalProperties": false,
"required": [
"data",
"claim"
],
"properties": {
"data": {
"type": "object",
"additionalProperties": false,
"required": [
"cell_lengths_angstrom",
"cell_angles_degrees",
"wavelength_angstrom",
"atoms",
"reflections"
],
"properties": {
"cell_lengths_angstrom": {
"type": "array",
"items": {
"type": "number",
"minimum": 0.1,
"maximum": 1000
},
"minItems": 3,
"maxItems": 3
},
"cell_angles_degrees": {
"type": "array",
"items": {
"type": "number",
"minimum": 1,
"maximum": 179
},
"minItems": 3,
"maxItems": 3
},
"wavelength_angstrom": {
"type": "number",
"minimum": 0.01,
"maximum": 10
},
"atoms": {
"type": "array",
"items": {
"type": "object",
"additionalProperties": false,
"required": [
"fractional_position",
"occupancy",
"scattering_amplitude",
"debye_waller_b"
],
"properties": {
"fractional_position": {
"type": "array",
"items": {
"type": "number",
"minimum": -10,
"maximum": 10
},
"minItems": 3,
"maxItems": 3
},
"occupancy": {
"type": "number",
"minimum": 0,
"maximum": 1
},
"scattering_amplitude": {
"type": "array",
"items": {
"type": "number",
"minimum": -10000,
"maximum": 10000
},
"minItems": 2,
"maxItems": 2
},
"debye_waller_b": {
"type": "number",
"minimum": 0,
"maximum": 1000
}
}
},
"minItems": 1,
"maxItems": 32
},
"reflections": {
"type": "array",
"items": {
"type": "array",
"items": {
"type": "integer",
"minimum": -100,
"maximum": 100
},
"minItems": 3,
"maxItems": 3
},
"minItems": 1,
"maxItems": 32
}
}
},
"claim": {}
}
}
}
}
}
}Ergebnis & Dokumentation
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