Table 8 Adsorption energies (\({E}_{{\rm{ads}}}\)) of CO₂ and CH₄, charge transfers (Q) upon CO₂ adsorption, and maximum Gibbs free energy spans (\({G}_{\max }\)) of CO₂ reduction to CH₄ on the Nb₂NO₂ MXene surface doped with one atom of V, Cr, Mn, Fe, Co or Ni, according to the results of the calculations taken from ref.²⁰²

From: First-principles and machine-learning approaches for interpreting and predicting the properties of MXenes