foundry-ml

perovskite_opbandcenter_v1-1

O p-band center values for perovskite oxides — descriptors for catalytic activity prediction in oxygen-evolution reactions.

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Rows: 2,912
On disk: 76 kB
Downloads: 26
Updated: Dec 28

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min: 7
median: 12
mean: 12.80
max: 33

Composition with sublattices

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perovskite_opbandcenter_v1-1

How the columns are distributed

Composition

Composition with sublattices

O pband (GGA)_[eV]

O pband (GGA+U)_[eV]