CNDO model and interpretation of the photoelectron spectrum of CO chemisorbed on Ni
- 1 September 1974
- journal article
- Published by American Vacuum Society in Journal of Vacuum Science and Technology
- Vol. 11 (5) , 865-868
- https://doi.org/10.1116/1.1318080
Abstract
CNDO calculations for CO chemisorbed on a cluster of 10 Ni atoms produce a pattern of valence orbital energy levels that agrees well with the experimental photoelectron spectrum of CO adsorbed on Ni; thus allowing the experimental energies to be assigned to specific orbitals. The bonding of the carbon atom to the Ni atom largely involves nickel s and p orbitals, with little contribution from the d orbitals.Keywords
This publication has 0 references indexed in Scilit: