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Data of bifunctional oxygen electrocatalyst based on Fe, Co, and nitrogen co-...
This dataset contains the data presented in the figures of pulbished paper "Bifunctional oxygen electrocatalyst based on Fe, Co, and nitrogen co-doped graphene-coated alumina... -
Oxygen reduction reaction on single-atom catalysts from density functional th...
We present a density functional theory study of the oxygen reduction reaction (ORR) on a single atom catalyst embedded in graphene, namely, TM-N₄-C (TM = Fe and Co), using the... -
Data of oxygen reduction reaction on Pd nanocatalysts prepared by plasma-assi...
This dataset contains the data presented in the figures of published paper "Oxygen reduction reaction on Pd nanocatalysts prepared by plasma-assisted synthesis on different... -
Data of bifunctional oxygen electrocatalysis on mixed metal phthalocyanine-mo...
This dataset contains the data presented in the figures of the published paper "Bifunctional Oxygen Electrocatalysis on Mixed Metal Phthalocyanine-Modified Carbon Nanotubes... -
Data of bimetal phthalocyanine-modified carbon nanotube-based bifunctional ca...
This dataset contains the data presented in the figures of the published paper "Bimetal Phthalocyanine-Modified Carbon Nanotube-Based Bifunctional Catalysts for Zinc-Air... -
Comparative density functional theory study for predicting oxygen reduction a...
It has been well established that nitrogen coordinated transition metal, TM-N4-C (TM=Fe and Co) moieties, are responsible for the higher catalytic activity for the... -
Oxygen evolution and reduction on Fe‑doped NiOOH
This dataset includes the full computational workflows of a proof-of-concept study of various possible mechanisms (standard and bifunctional ones) for oxygen evolution reaction...