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تسجيل مستخدم جديدThe magnetic form factor of iron in SrFe2As2
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The iron magnetic form factor in SrFe2As2 has been determined by neutron diffraction and by density functional theory (DFT). As noted previously, the magnitude of the calculated moment using DFT is sensitive to the Fe-As distance. However, the shape of the calculated form factor is practically insensitive to the Fe-As distance, and further we show that the form factor closely resembles that of bcc iron, and agrees well with experiment. The spin density exhibits some anisotropy due to geometry and As hybridization.
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Electrical resistivity under high pressure have been measured on nominally pure SrFe2As2 up to 14 GPa. The resistivity drop appeared with increasing pressure, and we clearly observed zero resistivity. The maximum of superconducting transition tempera
ture (Tc) is 38 K. The value is corresponding to the one of optimally doping AFe2As2 (A=Sr, Ba) system with K+ ions at the A2+ site.
Neutron diffraction measurements have been carried out to investigate the magnetic form factor of the parent SrFe2As2 system of the iron-based superconductors. The general feature is that the form factor is approximately isotropic in wave vector, ind
icating that multiple d-orbitals of the iron atoms are occupied as expected based on band theory. Inversion of the diffraction data suggests that there is some elongation of the spin density toward the As atoms. We have also extended the diffraction measurements to investigate a possible jump in the c-axis lattice parameter at the structural phase transition, but find no detectable change within the experimental uncertainties.
We have performed neutron diffraction measurement on a single crystal of parent compound of iron-based superconductor, BaFe$_2$As$_2$ at 12~K. In order to investigate in-plane anisotropy of magnetic form factor in the antiferromagnetic phase, the det
winned single crystal is used in the measurement. The magnetic structure factor and magnetic form factor are well explained by the spin densities consisting of $3d_{yz}$ electrons with a fraction of about 40~% and the electrons in the other four $3d$ orbitals with each fraction of about 15~%. Such anisotropic magnetic form factor is qualitatively consistent with the anisotropic magnetic behaviors observed in the antiferromagnetic phase of the parent compound of iron-based superconductor.
Polarized and unpolarized neutron diffraction measurements have been carried out to investigate the iron magnetic order in undoped NdOFeAs. Antiferromagnetic order is observed below 141(6) K, which is in close proximity to the structural distortion o
bserved in this material. The magnetic structure consists of chains of parallel spins that are arranged antiparallel between chains, which is the same in-plane spin arrangement as observed in all the other iron oxypnictide materials. Nearest-neighbor spins along the c-axis are antiparallel like LaOFeAs. The ordered moment is 0.25(7) muB, which is the smallest moment found so far in these systems.
We have grown single crystals of EuFe2As2 and investigated its electrical transport and thermodynamic properties. Electrical resistivity and specific heat measurements clearly establish the intrinsic nature of magnetic phase transitions at 20 K and 1
95 K. While the high temperature phase transition is associated with the itinerant moment of Fe, the low temperature phase transition is due to magnetic order of localized Eu-moments. Band structure calculations point out a very close similarity of the electronic structure with SrFe2As2. Magnetically, the Eu and Fe2As2 sublattice are nearly de-coupled.
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