Density-functional study of oxidation at the Mn–Co interface

Density-functional study of the CO adsorption on the ferromagnetic fcc Co(001) film surface

“…It is supposed that it grows epitaxially on the Cu(0 0 1) surface that is represented by two Cu layers in our model. (Some time ago, we have done extensive numerical tests in an analogous calculation of oxidized Co-Mn alloys above the Co/Cu(0 0 1) film [16]. The test has confirmed that the calculated surface properties are not sensitive to the number of Cu layers employed.)…”