property_id string | property_hash string | last_modified timestamp[us] | dataset_id string | multiplicity int32 | software string | method string | energy float64 | atomic_forces list | cauchy_stress list | cauchy_stress_volume_normalized bool | electronic_band_gap float64 | electronic_band_gap_type string | formation_energy float64 | adsorption_energy float64 | atomization_energy float64 | max_force_norm float64 | mean_force_norm float64 | energy_above_hull float64 | configuration_id string | configuration_hash string | structure_hash string | cell list | positions list | pbc list | chemical_formula_hill string | chemical_formula_reduced string | chemical_formula_anonymous string | elements list | elements_ratios list | atomic_numbers list | nsites int32 | nelements int32 | nperiodic_dimensions int32 | dimension_types list | names list | labels list | property_metadata_path string | configuration_metadata_path string | hash string | configuration_metadata string | property_metadata string |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
PO_4894763532930222929404089 | 4894763532930222929404089065198724068551230567621866477580873511381982311093105652489540761784270460719648644882743035817119703003407326672065157830999133 | 2025-04-16T16:06:08 | DS_8zft35i5sbgd_0 | 1 | VASP | DFT-PBE | -605.424604 | [
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PO_4896798901739428997280020 | 4896798901739428997280020160047199796688426591078011773751792406206099125082273540199766997482238583563761662151946567939692950963627705483220780059816244 | 2025-04-16T15:43:48 | DS_8zft35i5sbgd_0 | 1 | VASP | DFT-PBE | -195.168461 | [
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PO_4889398335409533727019718 | 4889398335409533727019718879783110184268401281545766609185106152152418311908869267408474278712367383507474931879035388911440043801413273439243449448089504 | 2025-04-16T15:18:37 | DS_8zft35i5sbgd_0 | 1 | VASP | DFT-PBE | -645.858403 | [
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