  Segregation, precipitation, and phase separation in Fe-Cr systems is
investigated. Monte Carlo simulations using semiempirical interatomic
potential, first-principles total energy calculations, and experimental
spectroscopy are used. In order to obtain a general picture of the relation of
the atomic interactions and properties of Fe-Cr alloys in bulk, surface, and
interface regions several complementary methods has to be used. Using Exact
Muffin-Tin Orbitals method the effective chemical potential as a function of Cr
content (0-15 at.% Cr) is calculated for a surface, second atomic layer and
bulk. At ~10 at.% Cr in the alloy the reversal of the driving force of a Cr
atom to occupy either bulk or surface sites is obtained. The Cr containing
surfaces are expected when the Cr content exceeds ~10 at.%. The second atomic
layer forms about 0.3 eV barrier for the migration of Cr atoms between bulk and
surface atomic layer. To get information on Fe-Cr in larger scales we use
semiempirical methods. Using combined Monte Carlo molecular dynamics
simulations, based on semiempirical potential, the precipitation of Cr into
isolated pockets in bulk Fe-Cr and the upper limit of the solubility of Cr into
Fe layers in Fe/Cr layer system is studied. The theoretical predictions are
tested using spectroscopic measurements. Hard X-ray photoelectron spectroscopy
and Auger electron spectroscopy investigations were carried out to explore Cr
segregation and precipitation in Fe/Cr double layer and Fe_0.95Cr_0.05 and
Fe_0.85Cr_0.15 alloys. Initial oxidation of Fe-Cr was investigated
experimentally at 10^-8 Torr pressure of the spectrometers showing intense
Cr_2O_3 signal. Cr segregation and the formation of Cr rich precipitates were
traced by analysing the experimental spectral intensities with respect to
annealing time, Cr content, and kinetic energy of the exited electron.
