Single atom tungsten doped ultrathin α-Ni(OH)<sub>2</sub> for enhanced electrocatalytic water oxidation.

Yan, Junqing; Kong, Lingqiao; Ji, Yujin; White, Jai; Li, Youyong; Zhang, Jing; An, Pengfei; Liu, Shengzhong et al. · Nat Commun · 2019

basic_science · Level V

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Abstract

Electrocatalytic water oxidation is a rate-determining step in the water splitting reaction. Here, we report one single atom W<sup>6+</sup> doped Ni(OH)<sub>2</sub> nanosheet sample (w-Ni(OH)<sub>2</sub>) with an outstanding oxygen evolution reaction (OER) performance that is, in a 1 M KOH medium, an overpotential of 237 mV is obtained reaching a current density of 10 mA/cm<sup>2</sup>. Moreover, at high current density of 80 mA/cm<sup>2</sup>, the overpotential value is 267 mV. The corresponding Tafel slope is measured to be 33 mV/dec. The d<sup>0</sup> W<sup>6+</sup> atom with a low spin-state has more outermost vacant orbitals, resulting in more water and OH<sup>-</sup> groups being adsorbed on the exposed W sites of the Ni(OH)<sub>2</sub> nanosheet. Density functional theory (DFT) calculations confirm that the O radical and O-O coupling are both generated at the same site of W<sup>6+</sup>. This work demonstrates that W<sup>6+</sup> doping can promote the electrocatalytic water oxidation activity of Ni(OH)<sub>2</sub> with the highest performance.