Fe Pnictides Research Articles

The Study of Coexistance of Superconductivity and Spin Glass in Fe Pnictide(Fe1+YSeXTe1−X)

Superconductivity and magnetism were previously thought as incompatible until the discovery of some rare earth ternary compounds that shows the coexistence of superconductivity and magnetism. In some of the recently discovered iron based layered superconductors superconductivity and diamagnetic order system are coexist. That occurs in only 11 and 122 family. The present works we examine the possibility of coexistence of superconductivity and disorder of magnetic spin is called spin glass when freeze the system that can show the superconductivity and spin glass coexist. In this present work we can examine the possibility of coexistence of superconductivity and spin glass in detailed 11 family of Fe1+ySexTe1−x compound. We show that spin glass like behavior is present in FST for x = 0.1 - 0.15 we present evidence form magnetization measurement and characterized the short-range order with neutron scattering. One of our main results is that the short-range order is structural as well as magnetic order. The factor of magnetic order exchange in long range depend on temperature, pressure, number of doping and other external factor discussed it. We found mathematical expression for superconductor transition TC, spin glass temperature TgSusceptibility x(q), and retardation time τ using for born approximation and digamma function depend on wave vector(q) and cut off frequency(ω) in the region coexistence of superconductivity and spin glass in Fe1+ySexTe1−xcompound.

Reciprocity between local moments and collective magnetic excitations in the phase diagram of BaFe2(As1\u2212xPx)2

Unconventional superconductivity arises at the border between the strong coupling regime with local magnetic moments and the weak coupling regime with itinerant electrons, and stems from the physics of criticality that dissects the two. Unveiling the nature of the quasiparticles close to quantum criticality is fundamental to understand the phase diagram of quantum materials. Here, using resonant inelastic x-ray scattering (RIXS) and {rm{Fe}}-{{rm{K}}}_{beta } emission spectroscopy (XES), we visualize the coexistence and evolution of local magnetic moments and collective spin excitations across the superconducting dome in isovalently-doped BaFe{}_{2}(As{}_{1-x}P{}_{x}){}_{2} (0.00 le x le 0.52). Collective magnetic excitations resolved by RIXS are gradually hardened, whereas XES reveals a strong suppression of the local magnetic moment upon doping. This relationship is captured by an intermediate coupling theory, explicitly accounting for the partially localized and itinerant nature of the electrons in Fe pnictides. Finally, our work identifies a local-itinerant spin fluctuations channel through which the local moments transfer spin excitations to the particle-hole (paramagnons) continuum across the superconducting dome.

Magnetic correlations in the pressure-induced superconductor CrAs investigated by As75 nuclear magnetic resonance

We report $^{75}$As-NMR results for CrAs under pressure, which shows superconductivity adjoining a helimagnetically ordered state. We successfully evaluated the Knight shift from the spectrum, which is strongly affected by the quadrupole interaction. The Knight shift shows the remarkable feature that the uniform spin susceptibility increases toward low temperatures in the paramagnetic state. This is in sharp contrast to CrAs at ambient pressure, and also to cuprates and Fe pnictides, where antiferromagnetic correlations are dominant. Superconductivity emerges in CrAs under unique magnetic correlations, which probably originate in the three-dimensional zigzag structure of its nonsymmorphic symmetry.

Multigap Superconductivity in RbCa2Fe4As4F2 Investigated Using μSR Measurements

The superconducting properties of the recently discovered double Fe$_2$As$_2$ layered high-$T_c$ superconductor RbCa$_2$Fe$_4$As$_4$F$_2$ with $T_c\approx$ 30~K have been investigated using magnetization, heat capacity, transverse-field (TF) and zero-field (ZF) muon-spin rotation/relaxation ($\mu$SR) measurements. Our low field magnetization measurements and heat capacity (C$_p$) reveal an onset of bulk superconductivity with $T_{\bf c}\sim$ 30.0(4) K. Furthermore, the heat capacity exhibits a jump at $T_{\bf c}$ of $\Delta$C$_p$/$T_{\bf c}$=94.6 (mJ/mole-K$^2$) and no clear effect of applied magnetic fields was observed on C$_p$(T) up to 9 T between 2 K and 5 K. Our analysis of the TF-$\mu$SR results shows that the temperature dependence of the magnetic penetration depth is better described by a two-gap model, either isotropic $s$+$s$-wave or $s$+$d$-wave than a single gap isotropic $s$-wave or $d$-wave model for the superconducting gap. The presence of two superconducting gaps in RbCa$_2$Fe$_4$As$_4$F$_2$ suggests a multiband nature of the superconductivity, which is consistent with the multigap superconductivity observed in other Fe-based superconductors, including ACa$_2$Fe$_4$As$_4$F$_2$ (A=K and Cs). Furthermore, from our TF-$\mu$SR study we have estimated an in-plane penetration depth $\lambda_{\mathrm{ab}}$$(0)$ =231.5(3) nm, superconducting carrier density $n_s = 7.45 \times 10^{26}~ $m$^{-3}$, and carrier's effective-mass $m^*$ = 2.45\textit{m}$_{e}$. Our ZF $\mu$SR measurements do not reveal a clear sign of time reversal symmetry breaking at $T_{\bf c}$, but the temperature dependent relaxation between 150 K and 1.2 K might indicate the presence of spin-fluctuations. The results of our present study have been compared with those reported for other Fe pnictide superconductors.

Coexistence of superconductivity and ferromagnetism in Eu-based Fe pnictides

Coexistence of superconductivity and ferromagnetism in Eu-based Fe pnictides

Magnetic moment evolution and spin freezing in doped BaFe2As2

Fe-Kβ X-ray emission spectroscopy measurements reveal an asymmetric doping dependence of the magnetic moments μbare in electron- and hole-doped BaFe2As2. At low temperature, μbare is nearly constant in hole-doped samples, whereas it decreases upon electron doping. Increasing temperature substantially enhances μbare in the hole-doped region, which is naturally explained by the theoretically predicted crossover into a spin-frozen state. Our measurements demonstrate the importance of Hund’s-coupling and electronic correlations, especially for hole-doped BaFe2As2, and the inadequacy of a fully localized or fully itinerant description of the 122 family of Fe pnictides.

Phase stability and large in-plane resistivity anisotropy in the 112-type iron-based superconductor Ca1−xLaxFeAs2

The recently discovered high-T$_c$ superconductor Ca$_{1-x}$La$_{x}$FeAs$_{2}$ is a unique compound not only because of its low symmetry crystal structure, but also because of its electronic structure which hosts Dirac-like metallic bands resulting from (spacer) zig-zag As chains. We present a comprehensive first principles theoretical study of the electronic and crystal structures of Ca$_{1-x}$La$_{x}$FeAs$_{2}$. After discussing the connection between the crystal structure of the 112 family, which Ca$_{1-x}$La$_{x}$FeAs$_{2}$ is a member of, with the other known structures of Fe pnictide superconductors, we check the thermodynamic phase stability of CaFeAs$_{2}$, and similar hyphothetical compounds SrFeAs$_{2}$ and BaFeAs$_{2}$ which, we find, are slightly higher in energy. We calculate the optical conductivity of Ca$_{1-x}$La$_{x}$FeAs$_{2}$ using the DFT + DMFT method, and predict a large in-plane resistivity anisotropy in the normal phase, which does not originate from electronic nematicity, but is enhanced by the electronic correlations. In particular, we predict a 0.34 eV peak in the $yy$ component of the optical conductivity of the 30\% La doped compound, which correponds to coherent interband transitions within a fast-dispersing band arising from the zig-zag As-chains which are unique to this compound. We also study the Landau free energy for Ca$_{1-x}$La$_{x}$FeAs$_{2}$ including the order parameter relevant for the nematic transition and find that the free energy does not have any extra terms that could induce ferro-orbital order. This explains why the presence of As chains does not broaden the nematic transition in Ca$_{1-x}$La$_{x}$FeAs$_{2}$.

Presence of magnetic excitations in SmFeAsO

We measured dispersive spin excitations in SmFeAsO, a parent compound of SmFeAsO1−xFx and one of the highest temperature superconductors of Fe pnictides (TC ≈ 55 K). We determine the magnetic excitations to disperse with a bandwidth energy of ca 170 meV at (0.47, 0) and (0.34, 0.34), which merges into the elastic line approaching the Γ point. Comparing our results with other parent Fe pnictides, we show the importance of structural parameters for the magnetic excitation spectrum, with small modifications of the tetrahedron angles and As height strongly affecting the magnetism.

Of Substitution and Doping: Spatial and Electronic Structure in Fe Pnictides

A highly intriguing aspect in iron-pnictide superconductors is the composition-dependent electronic structure, in particular the question if and how charge carriers are introduced to the system upon substitution of Ba by alkali metals or of Fe by other transition metals, TM. We report on a systematic study of spatial structure and electronic states by x-ray diffraction and x-ray absorption on a large number of compositions in the (Ba,K)(Fe,TM)2As2 family. The coherent combination of detailed structural information with an in-depth analysis of the electronic structure allows us to sensitively disentangle (charge-carrier) "doping" effects from "substitutional" effects. Results include a doping character that is site-decoupled, as well as TM 3d energy-level schemes that exhibit non-standard level sequences and even t2-e level crossings. Our study indicates that doping per se seems to play a lesser role than expected for pnictide superconductivity and magnetism.

An Intercomparison of the Upper Critical Fields (H c 2 ) of Different Superconductors—YBa2Cu3 O 7, MgB2, NdFeAsO 0 . 8 F 0 . 2 , FeSe 0 . 5 Te 0 . 5 and Nb2PdS5

Here, we report the comparison of the upper critical fields of different superconductors being calculated by two different theories, i.e. Werthamer Helfand Hohenburg (WHH) and Ginzberg Landau (GL). All the samples are synthesized through previously known solid-state reaction route. Phase purity is determined from the Rietveld refinement of powder X-ray diffraction (XRD) data. High-field (up to 14 T) magneto transport ρ(T)H of different superconductors is studied to estimate their upper critical field (H c2). The present intercomparison covers from cuprates (YBa2Cu3 O 7)–borides (MgB2)–Fe pnictides (NdFeAsO0.8 F 0.2) and chalcogenides (FeSe0.5Te0.5) to robust Nb2PdS5. The upper critical fields [ H c2(T)] at zero temperature are calculated by extrapolating the data using GL and WHH equations.

Structural and magnetic phase transitions inCa0.73Le0.27FeAs2with electron-overdoped FeAs layers

We report a study of the Ca$_{0.73}$La$_{0.27}$FeAs$_2$ single crystals. We unravel a monoclinic to triclinic phase transition at 58 K, and a paramagnetic to stripe antiferromagnetic (AFM) phase transition at 54 K, below which spins order 45$^\circ$ away from the stripe direction. Furthermore, we demonstrate this material is substantially structurally untwinned at ambient pressure with the formation of spin rotation walls (S-walls). Finally, in addition to the central-hole and corner-electron Fermi pockets usually appearing in Fe pnictide superconductors, angle-resolved photoemission (ARPES) measurements resolve a Fermiology where an extra electron pocket of mainly As chain character exists at the Brillouin zone edge.

Spin excitations in a model of FeSe with orbital ordering

We present a theoretical study of the dynamical spin susceptibility for the intriguing Fe-based superconductor FeSe, based on a tight-binding model developed to account for the temperature-dependent band structure in this system. The model allows for orbital ordering in the $d_{xz}/d_{yz}$ channel below the structural transition and presents a strongly $C_4$ symmetry broken Fermi surface at low temperatures which accounts for the nematic properties of this material. The calculated spin excitations are peaked at wave vector $(\pi,0)$ in the 1-Fe Brillouin zone, with a broad maximum at energies of order a few meV. In this range, the occurrence of superconductivity sharpens this peak in energy, creating a $(\pi,0)$ "neutron resonance" as seen in recent experiments. With the exception of the quite low energy scale of these fluctuations, these results are roughly similar to standard behavior in Fe pnictide systems. At higher energies, however, intensity increases and shifts to wave vectors along the $(\pi,0)$ - $(\pi,\pi)$ line. We compare with existing inelastic neutron experiments and NMR data, and give predictions for further studies.

Spin waves and spatially anisotropic exchange interactions in theS=2stripe antiferromagnetRb0.8Fe1.5S2

An inelastic neutron scattering study of the spin waves corresponding to the stripe antiferromagnetic order in insulating Rb$_{0.8}$Fe$_{1.5}$S$_2$ throughout the Brillouin zone is reported. The spin wave spectra are well described by a Heisenberg Hamiltonian with anisotropic in-plane exchange interactions. Integrating the ordered moment and the spin fluctuations results in a total moment squared of $27.6\pm4.2\mu_B^2$/Fe, consistent with $\mathrm{S \approx 2}$. Unlike $X$Fe$_2$As$_2$ ($X=$ Ca, Sr, and Ba), where the itinerant electrons have a significant contribution, our data suggest that this stripe antiferromagnetically ordered phase in Rb$_{0.8}$Fe$_{1.5}$S$_2$ is a Mott-like insulator with fully localized $3d$ electrons and a high-spin ground state configuration. Nevertheless, the anisotropic exchange couplings appear to be universal in the stripe phase of Fe pnictides and chalcogenides.

Emergence of high-mobility minority holes in the electrical transport of theBa(Fe1−xMnxAs)2iron pnictides

In Fe pnictide (Pn) superconducting materials, neither Mn- nor Cr- doping to the Fe site induces superconductivity, even though hole carriers are generated. This is in strong contrast with the superconductivity appearing when holes are introduced by alkali metal substitution on the insulating blocking layers. We investigate in detail the effects of Mn doping on magneto-transport properties in Ba(Fe$_{1-x}$Mn$_x$As)$_2$ for elucidating the intrinsic reason. The negative Hall coefficient for $x$ = 0 estimated in the low magnetic field ($B$) regime gradually increases as $x$ increases, and its sign changes to a positive one at $x$ = 0.020. Hall resistivities as well as simultaneous interpretation using the magnetoconductivity tensor including both longitudinal and transverse transport components clarify that minority holes with high mobility are generated by the Mn doping via spin density wave (SDW) transition at low temperatures, while original majority electrons and holes residing in the parabolic-like Fermi surfaces (FSs) of the semimetallic Ba(FeAs)$_2$ are negligibly affected. Present results indicate that the mechanism of hole doping in Ba(Fe$_{1-x}$Mn$_x$As)$_2$ is greatly different from that of the other superconducting FePns family.

Electronic Properties of BaFe2As2 upon Doping and Pressure: The Prominent Role of the As p Orbitals.

Using high-resolution, lifetime removed, x-ray absorption spectroscopy at the As K edge, we evidence the strong sensitivity of the As electronic structure upon electron doping with Co or pressure change in BaFe2As2, at room temperature. Our results unravel the prominent role played by As-4p orbitals in the electronic properties of the Fe pnictide superconductors. We propose a unique picture to describe the overall effect of both external parameter doping and pressure, resolving the apparent contradiction between angle-resolved photoemission spectroscopy, transport, and absorption results, with the As-p states as a key ingredient.

Ultrafast structural dynamics of the Fe-pnictide parent compound BaFe(2)As(2).

Using femtosecond time-resolved x-ray diffraction we investigate the structural dynamics of the coherently excited A(1g) phonon mode in the Fe-pnictide parent compound BaFe(2)As(2). The fluence dependent intensity oscillations of two specific Bragg reflections with distinctly different sensitivity to the pnictogen height in the compound allow us to quantify the coherent modifications of the Fe-As tetrahedra, indicating a transient increase of the Fe magnetic moments. By a comparison with time-resolved photoemission data, we derive the electron-phonon deformation potential for this particular mode. The value of Δμ/Δz=-(1.0-1.5) eV/Å is comparable with theoretical predictions and demonstrates the importance of this degree of freedom for the electron-phonon coupling in the Fe pnictides.

Structural origin of the anomalous temperature dependence of the local magnetic moments in the CaFe2As2 family of materials.

We report a combination of Fe Kβ x-ray emission spectroscopy and density functional reduced Stoner theory calculations to investigate the correlation between structural and magnetic degrees of freedom in CaFe2(As1-xPx)2. The puzzling temperature behavior of the local moment found in rare earth-doped CaFe2As2 [H. Gretarsson et al., Phys. Rev. Lett. 110, 047003 (2013)] is also observed in CaFe2(As1-xPx)2. We explain this phenomenon based on first-principles calculations with scaled magnetic interaction. One scaling parameter is sufficient to describe quantitatively the magnetic moments in both CaFe2(As1-xPx)2 (x=0.055) and Ca0.78La0.22Fe2As2 at all temperatures. The anomalous growth of the local moments with increasing temperature can be understood from the observed large thermal expansion of the c-axis lattice parameter combined with strong magnetoelastic coupling. These effects originate from the strong tendency to form As-As dimers across the Ca layer in the CaFe2As2 family of materials. Our results emphasize the dual local-itinerant character of magnetism in Fe pnictides.

Time-reversal symmetry breaking superconductivity in the coexistence phase with magnetism in Fe pnictides.

We argue that superconductivity in the coexistence region with spin-density-wave (SDW) order in weakly doped Fe pnictides erdiffers qualitatively from the ordinary s(+-) state outside the coexistence region as it develops an additional gap component which is a mixture of intrapocket singlet (s(++)) and interpocket spin-triplet pairings (the t state). The coupling constant for the t channel is proportional to the SDW order and involves interactions that do not contribute to superconductivity outside of the SDW region. We argue that the s(+-)- and t-type superconducting orders coexist at low temperatures, and the relative phase between the two is, in general, different from 0 or π, manifesting explicitly the breaking of the time-reversal symmetry promoted by long-range SDW order. We argue that time reversal may get broken even before true superconductivity develops.

Local moments and suppression of antiferromagnetism in correlated Zr4Fe4Si7

We report magnetic, transport, and neutron diffraction measurements as well as a doping study of the V-phase compound Zr${}_{4}$Fe${}_{4}$Si${}_{7}$. This compound exhibits collinear antiferromagnetic order below ${T}_{N}=98\ifmmode\pm\else\textpm\fi{}1$ K with a staggered moment of 0.57(3)${\ensuremath{\mu}}_{B}/$Fe as $T\ensuremath{\rightarrow}$ 0. The magnetic order can be quenched with Co substitution to the Fe site, but even then a 1.5${\ensuremath{\mu}}_{B}/$Fe paramagnetic moment remains. The resistivity and heat capacity of Zr${}_{4}$Fe${}_{4}$Si${}_{7}$ are Fermi-liquid-like below 16 and 7 K, respectively, and reveal correlations on the scale of those observed in superconducting Fe pnictides and chalcogenides. Electronic structure calculations overestimate the ordered moment, suggesting the importance of dynamical effects. The existence of magnetic order, electronic correlations, and spin fluctuations make Zr${}_{4}$Fe${}_{4}$Si${}_{7}$ distinct from the majority of Fe-Si compounds, fostering comparison instead with the parent compounds of Fe-based superconductors.

Electron–phonon coupling in 122 Fe pnictides analyzed by femtosecond time-resolved photoemission

Based on the results from femtosecond time-resolved photoemission, we compare three different methods for the determination of the electron–phonon coupling constant λ in Eu- and Ba-based 122 FeAs compounds. We find good agreement between all three methods, which reveal a small λ < 0.2. This makes simple electron–phonon-mediated superconductivity unlikely in these compounds.