fig2

Smart design of Rh-based hydrogen evolution electrocatalysts: integrating DFT, machine learning, and structural optimization for sustainable hydrogen energy

Figure 2. (A) Gibbs free energy diagram of the HER on TM-doped BNTs. (B) The volcano relationship between the Ead of H and the overpotential of HER on TM-doped BNTs. (C-E) The partial density of states (PDOS) of the transition metal-doped BNTs. This figure is reproduced from Ref.[69] with permission. Copyright 2022, Royal Society of Chemistry.

Energy Materials
ISSN 2770-5900 (Online)
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