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Author(s):   Hannachi, Y.; Mascetti, J.; Stirling, A.; Papai, I.
Title:   Metal Insertion Route of the Ni + CO2 -> NiO + CO Reaction
Journal:   J. Phys. Chem. A
Volume:   107
Page(s):   6708 - 6713
Year:   2003
Reference type:   Journal article
Squib:   2003HAN/MAS6708-6713

Reaction:   CO2 + Ni → CO + NiO
Reaction order:   2
Rate expression:   no rate data available
Category:  Theory
Data type:   Ab initio
Comments:   The gas-phase reaction of the nickel atom with CO2 molecule is investigated at the B3LYP and CCSD(T) levels of theory.

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