Partial phonon densities of states of Fe in Fe-Cr: Analysis by a local-order cluster expansion

Nuclear resonant inelastic x-ray scattering spectra were measured for Fe in disordered body-centered-cubic alloys of Fe-Cr. Partial phonon density of states DOS curves were obtained from these data. These results, in conjunction with the results of Ruckert et al. Hyperfine Interact. 126, 363 2000 on Fe-Cr thin-film multilayers and alloys, were analyzed with a local-order cluster expansion method. Interaction partial phonon DOS functions for the different short-range correlation functions were obtained from the disordered alloys. These interaction DOS functions were used in reconstructing the Fe partial DOS curves measured by Ruckert et al. on a set of thin-film multilayer samples of Fe/ Fe/Cr. The method worked well using terms up to a combined firstand second-nearest-neighbor triangle cluster, which were obtained reliably from the disordered alloys. The limitations of a basis set of correlation functions from disordered alloys are discussed but shown to be acceptable for the chemical trends of phonons in the Fe-Cr system.