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Total and partial electronic density of states for: A) bulk ZnAl–LDH and B) Vo‐doped ZnAl–LDH system. C) DFT‐calculated adsorption energies of CO2 and H2O molecules on LDH with or without defects. D) Charge‐density distribution of the defective ZnAl‐LDH. Reproduced with permission.49
