Theoretical study of the catalytic performance of fe and cu single-atom catalysts supported on mo c toward the reverse water gas shift reaction

HIGHLIGHTS

• who: Cu/Mo and colleagues from the University of Calabria, Italy have published the research: Theoretical study of the catalytic performance of Fe and Cu single-atom catalysts supported on Mo C toward the reverse water gas shift reaction, in the Journal: (JOURNAL)
• what: The authors focus on the CO2 activation and the H2O formation, which involve the adsorption of reactants, direct CO2 dissociation through the redox mechanism (CO2* u2192 CO* + O*), H2 dissociation (H2* u2192 H* + H*), and water formation (2H* + O* u2192 H2O*) (Alonso et_al, 2021). et_al, 2011).
• how: For gas . . .
  

   

  

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