Table 3 Materials in the dataset with bulk energy above hull below 0.3 eV/atom and thermodynamic overpotential below 0.6 V

From: Towards atom-level understanding of metal oxide catalysts for the oxygen evolution reaction with machine learning

chemical formula

miller index

thermodynamic overpotential (V)

La0.5Sr0.5CoO3

(211)

0.21

Co0.5Ru0.5O2

(110)

0.27

CaAuO3

(010)

0.29

EuMnO3

(010)

0.31

LaBeO3

(111)

0.32

KSbO3

(101)

0.35

CaBiO3

(010)

0.40

SrRhO3

(010)

0.41

LiNbO3

(010)

0.41

MnVO3

(010)

0.41

LiRhO3

(110)

0.43

CaVO3

(001)

0.45

BaRhO3

(010)

0.46

La0.75Sr0.25MnO3

(100)

0.50

AgTeO3

(010)

0.50

BaMnO3

(010)

0.51

BaCoO3

(010)

0.51

BiScO3

(010)

0.57

LaNiO3

(211)

0.57

PrNiO3

(320)

0.59

  1. Materials are sorted by thermodynamic overpotential, showing lowest to highest.