Related papers: Magnetic states of iron-based superconducting comp…
A puzzle in the iron-based superconductor LaFeAsO_{1-x}F_x is that the magnetic moment obtained by first-principle electronic structure calculations is unexpectedly much larger than the experimentally observed one. For example, the…
The magnetic properties of iron-arsenides are investigated using the LSDA+U approach. In addition to one high moment state, we find that a positive U also produces two low moment states with m~0.4 $\mu_{B}$ and m~1.0 $\mu_{B}$. The…
The coupling of Fe magnetic moments in LaFeAsO$_{1-x}$F$_{x}$ with the As $A_{1g}$ phonon is calculated. We present first principles calculations of the atomic and electronic structure of LaFeAsO as a function of electron doping. We perform…
We report the measurements of anisotropic magnetization and magnetoresistance on single crystals of EuFe$_2$As$_2$, a parent compound of ferro-arsenide high-temperature superconductor. Apart from the antiferromagnetic (AFM)…
The optical conductivity of LaFeAsO, BaFe$_2$As$_2$, SrFe$_2$As$_2$, and EuFe$_2$As$_2$ in the spin-density wave (SDW) state is investigated within density functional theory (DFT) in the framework of spin-polarized generalized gradient…
The interplay between superconductivity and magnetism is an important subject in condensed matter physics. EuFe$_{2}$As$_{2}$-based iron pnictides could offer an interesting plateau to study their relationship that has attracted…
The wave-vector (q) and doping dependences of the magnetic energy, iron moment, and effective exchange interactions in LaFeAsO, BaFe2As2, and SrFe2As2\ are studied by self-consistent LSDA calculations for co-planar spin spirals. For the…
We present an experimental study of the local and collective magnetism of $\mathrm{EuFe_2As_2}$, that is isostructural with the high temperature superconductor parent compound $\mathrm{BaFe_2As_2}$. In contrast to $\mathrm{BaFe_2As_2}$,…
We have studied the magnetism in superconducting single crystals of EuFe2 As1.4 P0.6 by using the local probe techniques of zero-field muon spin rotation/relaxation and 151 Eu/57 Fe M\"ossbauer spec- troscopy. All of these measurements…
We report muon spin relaxation/rotation (uSR) measurements of single crystal Ba(Fe1-xCox)2As2 with x=0.038 and 0.047. Zero field (ZF)-uSR and Transverse field (TF)-iSR measurements of these underdoped samples find the presence of magnetism…
The magnetic order of the localized Eu$^{2+}$ spins in optimally-doped Eu(Fe$_{1-x}$Ir$_{x}$)$_{2}$As$_{2}$ ($\mathit{x}$ = 0.12) with superconducting transition temperature $\mathit{T_{SC}}$ = 22 K was investigated by single-crystal…
Using first-principles calculations, the electronic and magnetic properties of orthorhombic BaFeO$_{3}$ (BFO) are investigated with local spin density approximation (LSDA). The calculations reveal that at the optimized lattice volume BFO…
The accuracy of LDA + U total energies is tested by predicting the high pressure behavior of rocksalt-structured FeO, including metal-insulator and magnetic transitions, equation of state, and lattice strain, as functions of the Coulomb…
We report a systematic first-principles study on the recent discovered superconducting Ba$_{1-x}$K$_x$Fe$_2$As$_2$ systems ($x$ = 0.00, 0.25, 0.50, 0.75, and 1.00). Previous theoretical studies strongly overestimated the magnetic moment on…
We report a first-principles study of the magnetic properties, site disorder and magneto-structural coupling in multiferroic gallium ferrite (GFO) using local spin density approximation (LSDA+U) of density functional theory. The…
We present a systematic study on the physical properties of EuFe$_{2-x}$Ni$_{x}$As$_{2}$ (0$\leq$\emph{x}$\leq$0.2) by electrical resistivity, magnetic susceptibility and thermopower measurements. The undoped compound EuFe$_{2}$As$_{2}$…
Among iron 122 pnictide superconductors, the EuFe$_2$As$_2$ series draws particular interest because, in addition to superconductivity or the long-range spin-density-wave order in the Fe subsystem, the localized Eu$^{2+}$ magnetic moments…
In contrast to SrFe2As2, where only the iron possesses a magnetic moment, in EuFe2As2 an additional large, local magnetic moment is carried by Eu2+. Like SrFe2As2, EuFe2As2 exhibits a spin-density wave transition at high temperatures, but…
In this paper we report comprehensive experimental and theoretical investigation of magnetic and electronic properties of the intermetallic compounds Pr2Fe17 and Gd2Fe17. For the first time electronic structure of these two systems was…
An extended investigation of the electronic phase diagram of FeSe$_{1-x}$ up to pressures of $p\simeq2.4$\,GPa by means of ac and dc magnetization, zero field muon spin rotation (ZF $\mu$SR), and neutron diffraction is presented. ZF $\mu$SR…