Table 1 Enthalpies of formation of the supercells consisting of several layers of stoichiometric K-phase and one layer of modified K-phase
From: Fe-Al-C carbide phase nano-layer investigation as a substrate for epitaxial diamond growth
Composition | Enthalpies of formation (eV/atom) |
---|---|
One Fe3AlC + modified | 0.017 |
Two Fe3AlC + modified | 0.008 |
Three Fe3AlC + modified | −0.011 |
Four Fe3AlC + modified | −0.015 |