P‐d orbital hybridization engineered single‐atom catalyst for electrocatalytic ammonia synthesis

HIGHLIGHTS

  • who: Yu and collaborators from the (UNIVERSITY) have published the article: pu2010d orbital hybridization engineered singleu2010atom catalyst for electrocatalytic ammonia synthesis, in the Journal: (JOURNAL)
  • what: Adsorption energies of intermediates.

SUMMARY

    The comparison results reveal that N2 molecules prefer to be absorbed as the end-on configuration. According to the Sabatier principle, the ideal NRR catalysts should have moderate adsorption energy for different intermediates (N2, NNH, NH, NH2, and NH3, etc.), which should not be too strong or too weak. The results show that for good NRR catalytic activities, the p . . .

     

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