A density functional theory investigation on the mechanism and kinetics of dimethyl carbonate formation on Cu2 O catalyst.

Zhang, Riguang

A density functional theory investigation on the mechanism and kinetics of dimethyl carbonate formation on Cu2 O catalyst. [electronic resource] - Journal of computational chemistry Apr 2012 - 1101-10 p. digital

Publication Type: Journal Article

1096-987X

10.1002/jcc.22939 doi


Catalysis
Copper--chemistry
Formates--chemical synthesis
Kinetics
Quantum Theory