publication string | equation string | reaction_energy float64 | miller_index list | sites string | other_structure list | other_structure_energy list | reactant_slab list | reactant_slab_energy list | product_slab list | product_slab_energy list | reactant_molecule list | reactant_molecule_energy list | product_molecule list | product_molecule_energy list | reactant_adslab list | reactant_adslab_energy list | product_adslab list | product_adslab_energy list | reactant_other list | reactant_other_energy list | product_other list | product_other_energy list | __index_level_0__ int64 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
CatalysisHub-BalzarettiDensity2024 | 0.5H2(g) + * -> H* | -0.607621 | [
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CatalysisHub-BalzarettiDensity2024 | 0.5H2(g) + * -> H* | -0.043727 | [
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CatalysisHub-BalzarettiDensity2024 | 0.5H2(g) + * -> H* | -0.846191 | [
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12.781... | [
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CatalysisHub-BalzarettiDensity2024 | 0.5H2(g) + * -> H* | -0.083751 | [
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CatalysisHub-BalzarettiDensity2024 | 0.5H2(g) + * -> H* | -0.3813 | [
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CatalysisHub-BalzarettiDensity2024 | 0.5H2(g) + * -> H* | -0.966155 | [
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12.572... | [
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CatalysisHub-BalzarettiDensity2024 | 0.5H2(g) + * -> H* | -0.624529 | [
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CatalysisHub-BalzarettiDensity2024 | 0.5H2(g) + * -> H* | -0.043727 | [
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CatalysisHub-BalzarettiDensity2024 | 0.5H2(g) + * -> H* | -0.846191 | [
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12.781... | [
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CatalysisHub-BalzarettiDensity2024 | 0.5H2(g) + * -> H* | -0.083751 | [
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CatalysisHub-BalzarettiDensity2024 | 0.5H2(g) + * -> H* | -0.92973 | [
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12.5312
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CatalysisHub-BalzarettiDensity2024 | 0.5H2(g) + * -> H* | -0.283573 | [
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12.163... | [
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12.163... | [
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CatalysisHub-BalzarettiDensity2024 | 0.5H2(g) + * -> H* | -0.476387 | [
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12.197... | [
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12.197... | [
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CatalysisHub-BalzarettiDensity2024 | 0.5H2(g) + * -> H* | -0.928691 | [
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12.34... | [
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CatalysisHub-BalzarettiDensity2024 | 0.5H2(g) + * -> H* | -0.260277 | [
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CatalysisHub-BalzarettiDensity2024 | 0.5H2(g) + * -> H* | -0.3542 | [
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CatalysisHub-BalzarettiDensity2024 | 0.5H2(g) + * -> H* | 0.335308 | [
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CatalysisHub-BalzarettiDensity2024 | 0.5H2(g) + * -> H* | 0.355377 | [
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CatalysisHub-BalzarettiDensity2024 | 0.5H2(g) + * -> H* | -0.773031 | [
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CatalysisHub-BalzarettiDensity2024 | 0.5H2(g) + * -> H* | -0.364441 | [
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CatalysisHub-BalzarettiDensity2024 | 0.5H2(g) + * -> H* | -0.531364 | [
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CatalysisHub-BalzarettiDensity2024 | 0.5H2(g) + * -> H* | -0.555055 | [
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CatalysisHub-BalzarettiDensity2024 | 0.5H2(g) + * -> H* | -0.918779 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | 1.837903 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | -1.633364 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | 0.685707 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | 0.71847 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | -0.97223 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | -0.674388 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | -8.744218 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | -0.273124 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | -0.128309 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | 1.638302 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | 1.441175 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | -0.653153 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | -0.491286 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | -0.904408 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | -2.136618 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | -0.676948 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | -0.821602 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | 1.544247 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | -0.415435 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | -0.743992 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | -3.59505 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | -0.589209 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | -0.669568 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | -1.913608 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | -1.138706 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | -0.710827 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | -0.881063 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | 0.881116 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | -2.269942 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | -2.133539 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | -2.008297 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | -1.910511 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | 0.657298 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | 0.532035 | [
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CatalysisHub-HansenFirst2018 | H2(g) + 2.0* -> 2.0H* | 1.251594 | [
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CatalysisHub-MamunHighT2019 | 0.5H2(g) + * -> H* | 0.095781 | [
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CatalysisHub-MamunHighT2019 | 0.5H2(g) + * -> H* | -0.176323 | [
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CatalysisHub-MamunHighT2019 | 0.5H2(g) + * -> H* | 0.62529 | [
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CatalysisHub-MamunHighT2019 | 0.5H2(g) + * -> H* | 0.997302 | [
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CatalysisHub-MamunHighT2019 | 0.5H2(g) + * -> H* | 0.420044 | [
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CatalysisHub-MamunHighT2019 | 0.5H2(g) + * -> H* | -0.990126 | [
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CatalysisHub-MamunHighT2019 | 0.5H2(g) + * -> H* | -0.539132 | [
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CatalysisHub-MamunHighT2019 | 0.5H2(g) + * -> H* | 1.185361 | [
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CatalysisHub-MamunHighT2019 | 0.5H2(g) + * -> H* | -0.126653 | [
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CatalysisHub-MamunHighT2019 | 0.5H2(g) + * -> H* | -0.153774 | [
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CatalysisHub-MamunHighT2019 | 0.5H2(g) + * -> H* | 0.609511 | [
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CatalysisHub-MamunHighT2019 | 0.5H2(g) + * -> H* | -0.86735 | [
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