The atomic structure of Fe(110)

Magnetism in strained pseudomorphic ultrathin films of fcc 3d-transition metals (Cr, Mn, Fe, Co and Ni) with lateral lattice parameters of bulk fcc-

“…In Table 3 we report the relaxations of atomic layers normal to the surface. These are found to be in reasonable agreement with experimental results [38,39]. Overall, the results show that the slab models describe the thin films very well and that this technique is likely to have predictive character if applied to more complicated problems.…”

“…The results given in Tables 1-3 are in good agreement with experimental results [37][38][39] and computational theoretical results [40]. Moreover, the surface energies as given in Table 1 are in good agreement with the broken-bond model [41].…”

“…Surface relaxations as the percentage of bulk interlayer spacing for first five layers of bcc Fe are compared with the available theoretical [40] and experimental results [38,39] in this table. dz1; dz2; .…”

Embedded-atom potential for Fe and its application to self-diffusion on Fe(100)

“…This feature is compatible with the appearance of exchange diffusion mechanism, with increasing temperature, which will be described in the next section. Table 5 summarizes the calculated surface relaxations for the (1 0 0), (1 1 0) and (1 1 1) faces of BCC-Fe at 2 K and 300 K, along with the respective experimental values determined by low-energy electron diffraction (LEED) and medium energy ion scattering (MEIS) [41][42][43][44][45][46][47]. We remark that the computed surface relaxations increase with temperature.…”

Photoemission study of some novel materials: rare earth/transition metal interface, Ba06K04BiO3 and AlPdMn

“…But this kind of reconstruction is not observed on many bcc(l 10) metal surfaces, including W, Mo, Fe, Na [Van Hove 1976, Morales de la Garza 1981, Shih 1980,Anderson 1977, Gafner 1976, Shih 1977, Lee 1977]. …”