Table 1 Format of each data record: description, key label, data type.
From: Text-mined dataset of inorganic materials synthesis recipes
YellowGreen Data description | Data Key Label | Data Type |
|---|---|---|
DOI of the original paper | doi | string |
Snippet of the raw text | paragraph_string | string |
Chemical equation | reaction | Object (dict): |
- element_substitution: | ||
- left_side: list of Objectsa | ||
- right_side: list of Objectsa | ||
Chemical equation in string format | reaction_string | string |
Target material data | target | Object (dict): |
- material_string: string, | ||
- material_formula: string, | ||
- composition: list of Objectsb, | ||
- additives: list of strings | ||
- elements_vars: {var: list of strings} | ||
- amounts_vars: {var: list of Objectsc} | ||
- oxygen_deficiency: boolean | ||
- mp_id: string | ||
List of target formulas obtained after variables substitution | targets_string | list of strings |
Precursor materials data | precursors | list of Objects (See target) |
Sequence of synthesis steps and corresponding conditions | operations | list of Objects (dict): |
- token: string, | ||
- type: string | ||
- conditions: Object | ||
–heating_temperature: list of Objectsd | ||
–heating_time: list of Objectsd, | ||
–heating_atmosphere: list of strings | ||
–mixing_device: list of strings | ||
–mixing_media: list of strings |