Using state-of-the-art first-principles calculations we have elucidated the complex magnetic and structural dependence of LaOFeAs upon doping. Our key findings are that (i) doping results in an orthorhombic ground state and (ii) there is a commensurate to incommensurate transition in the magnetic structure between $x=0.025$ and $x=0.04$. Our calculations further imply that in this system magnetic order persists up to the onset of superconductivity at the critical doping of $x=0.05$. Finally, our investigations of the undoped parent compound reveal an unusually pronounced dependence of the magnetic moment on details of the exchange-correlation (xc) functional used in the calculation. However, for all choices of xc functional an orthorhombic structure is found.
We present point-contact spectroscopy data for junctions between a normal metal and the newly discovered F-doped superconductor LaO$_{0.9}$F$_{0.1-δ}$FeAs (F-LaOFeAs). A zero-bias conductance peak was observed and its shape and magnitude suggests the presence of Andreev bound states at the surface of F-LaOFeAs, which provides a possible evidence of an unconventional pairing symmetry with a nodal gap function. The maximum gap value $Δ_0\approx3.9\pm0.7$meV was determined from the measured spectra, in good agreement with the recent experiments on specific heat and lower critical field.
The densities of the valence and conduction band electronic states of the newly discovered layered superconductors LaOFeAs, LaO$_{0.87}$F$_{0.13}$FeAs (Tc=26 K), SmO$_{0.95}$F$_{0.05}$FeAs and SmO$_{0.85}$F$_{0.15}$FeAs (Tc=43 K) are studied using soft X-ray absorption and emission spectroscopy combined with FP LAPW calculations of LaOFeAs, LaO$_{0.875}$FeAs and LaO$_{0.875}$F${0.125}$FeAs. The Fe 3d-states are localized in energy near the top of the valence band and are partially hybridized with p-type O (2p), As (4p), and La (6p) states approximately 3 eV below the Fermi energy. The Fe L3 X-…
We report the theoretical study of the flux-lattice melting in the novel iron-based superconductor $LaO_{0.9}F_{0.1}FeAs$ and $LaO_{0.925}F_{0.075}FeAs$. Using the Hypernetted-Chain closure and an efficient algorithm, we calculate the two-dimensional one-component plasma pair distribution functions, static structure factors and direct correlation functions at various temperatures. The Hansen-Verlet freezing criterion is shown to be valid for vortex-liquid freezing in type-II superconductors. Flux-lattice meting lines for $LaO_{0.9}F_{0.1}FeAs$ and $LaO_{0.925}F_{0.075}FeAs$ are predicted throu…
We have employed a new route to synthesize single phase F-doped LaOFeAs compound and confirmed the superconductivity above 20 K in this Fe-based system. We show that the new superconductor has a rather high upper critical field of about 54 T. A clear signature of superconducting gap opening below T$_c$ was observed in the far-infrared reflectance spectra, with 2$Δ/\textit{k}T_c\approx$3.5-4.2. Furthermore, we show that the new superconductor has electron-type conducting carrier with a rather low carrier density.
By using a two-step method, we successfully synthesized the iron based new superconductor LaO$_{0.9}$F$_{0.1-x}$FeAs. The Hall effect and magnetoresistance were measured in wide temperature region. A negative Hall coefficient R_H has been found implying a dominant conduction by electron-like charge carriers in this material. The charge carrier density determined at 100K is about 9.8E20 cm-3, which is close to the cuprate superconductors. It is further found that the magnetoresistance does not follow the Kohler's law. Meanwhile, the Hall coefficient, the resistivity at 0T, and magnetoresistance…
We report the specific heat measurements on the newly discovered Fe-based layered superconductor LaO_0.9F_{0.1-delta}FeAs with the onset transition temperature T_c \approx 28 K. A nonlinear magnetic field dependence of the electronic specific heat coefficient gamma(H) has been found in the low temperature limit, which is consistent with the prediction for a nodal superconductor. The maximum gap value Delta_0 \approx 3.4$\pm$0.5 meV was derived by analyzing gamma(H) based on the d-wave model. We also detected the electronic specific heat difference between 9 T and 0 T in wide temperature region…
We use group theory to classify the superconducting states of systems with two orbitals on a tetragonal lattice. The orbital part of the superconducting gap function can be either symmetric or anti-symmetric. For the orbital symmetric state, the parity is even for spin singlet and odd for spin triplet; for the orbital anti-symmetric state, the parity is odd for spin singlet and even for spin triplet. The gap basis functions are obtained with the use of the group chain scheme by taking into account the spin-orbit coupling. In the weak pairing limit, the orbital anti-symmetric state is only stab…
We have studied the newly found superconductor compound LaO$_{1-x}$F$_x$FeAs through the first-principles density functional theory calculations. We find that the parent compound LaOFeAs is a quasi-2-dimensional antiferromgnetic semimetal with most carriers being electrons and with a magnetic moment of $2.3μ_B$ located around each Fe atom on the Fe-Fe square lattice. Furthermore this is a commensurate antiferromagnetic spin density wave due to the Fermi surface nesting, which is robust against the F-doping. The observed superconduction happens on the Fe-Fe antiferromagnetic layer, suggesting a…
In this paper we calculate the electron-phonon coupling of the newly-discovered superconductor LaO$_{1-x}$F$_x$FeAs from first-principles, using Density Functional Perturbation Theory. For pure LaOFeAs, the calculated electron-phonon coupling constant $λ=0.21$ and logarithmic-averaged frequency $ω_{ln}=206 K$, give a maximum $T_c$ of 0.8 K, using the standard Migdal-Eliashberg theory. For the $F-$doped compounds, we predict even smaller coupling constants, due to the strong suppression of the electronic Density of States at the Fermi level. To reproduce the experimental $T_c=26 K$, a 5-6 times…
Using state-of-the-art first-principles calculations we study the magnetic behaviour of CeOFeAs. We find the Ce layer moments oriented perpendicular to those of the Fe layers. An analysis of incommensurate magnetic structures reveals that the Ce-Ce magnetic coupling is rather weak with, however, a strong Fe-Ce coupling. Comparison of the origin of the tetragonal to orthorhombic structural distortion in CeOFeAs and LaOFeAs show marked differences; in CeOFeAs the distortion is stabilized by a lowering of spectral weight at the Fermi level, while in LaOFeAs by a reduction in magnetic frustration.…
The 57Fe Mössbauer spectroscopy was applied to an iron-based layered superconductor LaO0.89F0.11FeAs with a transition temperature of 26 K and its parent material LaOFeAs. Throughout the temperature range from 4.2 to 298 K, a singlet spectrum with no magnetic splitting was observed as a main component of each Mössbauer spectrum of the F-doped superconductor. No additional internal magnetic field was observed for the spectrum measured at 4.2 K under a magnetic field of 7 T. On the other hand, the parent LaOFeAs shows a magnetic transition at around 140 K, and this temperature is slightly lower …
We report density functional theory calculations for the parent compound LaOFeAs of the newly discovered 26K Fe-based superconductor LaO$_{1-x}$F$_x$FeAs. We find that the ground state is an ordered antiferromagnet, with staggered moment about 2.3$μ_B$, on the border with the Mott insulating state. We fit the bands crossing the Fermi surface, derived from Fe and As, to a tight-binding Hamiltonian using maximally localized Wannier functions on Fe 3d and As 4p orbitals. The model Hamiltonian accurately describes the Fermi surface obtained via first-principles calculations. Due to the evident pro…
Diamagnetic susceptibility measurements under high hydrostatic pressure (up to 1.03 GPa) were carried out on the newly discovered Fe-based superconductor LaO_{1-x}F_{x}FeAs(x=0.11). The transition temperature T_c, defined as the point at the maximum slope of superconducting transition, was enhanced almost linearly by hydrostatic pressure, yielding a dT_c/dP of about 1.2 K/GPa. Differential diamagnetic susceptibility curves indicate that the underlying superconducting state is complicated. It is suggested that pressure plays an important role on pushing low T_c superconducting phase toward the …
We have performed 75As Nuclear Magnetic Resonance (NMR) measurements on aligned powders of the new LaO0.9F0.1FeAs superconductor. In the normal state, we find a strong temperature dependence of the spin shift and Korringa behavior of the spin lattice relaxation rate. In the superconducting state, we find evidence for line nodes in the superconducting gap and spin-singlet pairing. Our measurements reveal a strong anisotropy of the spin lattice relaxation rate, which suggest that superconducting vortices contribute to the relaxation rate when the field is parallel to the c-axis but not for the p…
Raman spectra have been measured on iron-based quaternary CeO$_{1-x}$F$_x$FeAs and LaO$_{1-x}$F$_x$FeAs with varying fluorine doping at room temperatures. A group analysis has been made to clarify the optical modes. Based on the first principle calculations, the observed phonon modes can be assigned accordingly. In LaO$_{1-x}$F$_x$FeAs, the E$_g$ and A$_{1g}$ modes related to the vibrations of La, are suppressed with increasing F doping. However F doping only has a small effect on the E$_g$ and A$_{1g}$ modes of Fe and As. The Raman modes of La and As are absent in rare-earth substituted CeO$_…
The electronic and magnetic properties of the mother material LaOFeAs of new superconductors have been carefully studied using first-principles electronic structure calculations based on the generalized gradient approximation in the density functional theory. The present calculation predicts that the ground state of LaOFeAs is antiferromagnetic with a stripe type magnetic moment alignment leading to orthorhombic symmetry of the crystal. In this particular magnetic state, the density of states at the Fermi level is very small. On the other hand, LaOFeP has turned out to be paramagnetic and a go…
We present zero field and transverse field \muSR experiments on the recently discovered electron doped Fe-based superconductor LaO_{1-x}F_xFeAs. The zero field experiments on underdoped (x=0.075) and optimally doped (x=0.1) samples rule out any static magnetic order above 1.6 K in these superconducting samples. From transverse field experiments in the vortex phase we deduce the temperature and field dependence of the superfluid density. Whereas the temperature dependence is consistent with a weak coupling BCS s-wave or a dirty d-wave gap function scenario, the field dependence strongly evidenc…
We report the first Nernst effect measurement on the new iron-based superconductor LaO$_{1-x}$F$_{x}$FeAs $(x=0.1)$. In the normal state, the Nernst signal is negative and very small. Below $T_{c}$ a large positive peak caused by vortex motion is observed. The flux flowing regime is quite large compared to conventional type-II superconductors. However, a clear deviation of the Nernst signal from normal state background and an anomalous depression of off-diagonal thermoelectric current in the normal state between $T_{c}$ and 50 K are observed. We propose that this anomaly in the normal state Ne…
The electron-phonon coupling of LaO$_{1-x}$F$_x$FeAs is re-investigated on the basis of density functional theory in local density approximation. The implications of the $(π,π)$ nesting of the Fermi surfaces are carefully studied and found to lead to a non-standard electron-phonon coupling of the corresponding Fe in-plane breathing mode, which might make a strong contribution to the high superconducting transition temperature. The semi-metallic behavior of the undoped material is also further illuminated.
High-resolution and high-flux neutron as well as X-ray powder-diffraction experiments were performed on the oxypnictide series LaO(1-x)FxFeAs with 0<x<0.15 in order to study the crystal and magnetic structure. The magnetic symmetry of the undoped compound corresponds to those reported for ReOFeAs (with Re a rare earth) and for AFe2As2 (A=Ba, Sr) materials. We find an ordered magnetic moment of 0.63(1)muB at 2 K in LaOFeAs, which is significantly larger than the values previously reported for this compound. A sizable ordered magnetic moment is observed up to a F-doping of 4.5% whereas there is …
Using angle-integrated photoemission spectroscopy we have probed the novel LaO$_{0.9}$F$_{0.1}$FeAs superconductor over a wide range of photon energies and temperatures. We have provided the first full characterization of the orbital character of the VB DOS and of the magnitude of the d-p hybridization energy. Finally, we have identified two characteristic temperatures: 90K where a pseudogap-like feature appears to close and 120K where a sudden change in the DOS near E$_F$ occurs. We associate these phenomena with the SDW magnetic ordering and the structural transition seen in the parent compo…
We report on the magnetic and superconducting properties of LaO0.5F0.5BiS2 by means of zero- (ZF) and transverse-field (TF) muon-spin spectroscopy measurements (uSR). Contrary to previous results on iron-based superconductors, measurements in zero field demonstrate the absence of magnetically ordered phases. TF-uSR data give access to the superfluid density, which shows a marked 2D character with a dominant s-wave temperature behavior. The field dependence of the magnetic penetration depth confirms this finding and further suggests the presence of an anisotropic superconducting gap.
The extensive ab initio total energy calculations using the VASP-PAW method with the generalized gradient approximation (GGA) for the exchange-correlation potential are applied to systematic investigation of structural, electronic and magnetic properties in quaternary oxybismuthides LaOMBi (where M = Sc, Ti...Ni, Cu). The energy spectrum features similar to lanthanum-iron oxyarsenide LaOFeAs and non-magnetic ground state are indicative of superconductivity possible in lanthanum-nickel oxybismuthide LaONiBi.
We present the first experimental results of the lower critical field $H_{c1}$ of the newly discovered F-doped superconductor LaO$_{0.9}$F$_{0.1}$FeAs (F-LaOFeAs) by global and local magnetization measurements. It is found that $H_{c1}$ showed an clear linear-$T$ dependence down to a temperature of 2 K, indicative of an unconventional pairing symmetry with a nodal gap function. Based on the d-wave model, we estimated a maximum gap value $Δ_0=4.0 \pm 0.6$ meV, in consistent with the recent specific heat and point-contact tunneling measurements. Taking the demagnetization factor into account, th…
Fundamental and higher harmonics of the AC magnetic susceptibility have been measured on a LaO_0.92F_0.08FeAs sample as a function of the temperature, at various amplitudes and frequencies of the AC magnetic field, with a small superimposed DC field parallel to the AC field. The granularity of the sample has been investigated and the inter-grain and intra-grain contributions have been clearly individuated looking at both the first and third harmonics. The vortex dynamics has been also analyzed, and a comparison with the magnetic behavior of both the MgB_2 and the cuprate superconductors has be…
We report upper critical field B_c2(T) data for disordered (arsenic-deficient) LaO_0.9F_0.1FeAs_(1-delta) in a wide temperature and magnetic field range up to 47 T. Because of the large linear slope of Bc2 about -5.4 T/K to -6.6 T/K near Tc = 28.5 K the T-dependence of the in-plane Bc2(T) shows a flattening near 23 K above 30 T which points to Pauli-limited behavior with Bc2(0) about 63-68 T. Our results are discussed in terms of disorder effects within conventional and unconventional superconducting pairings.
We discuss on the electromagnetic response of a polycrystalline sample of LaO_0.94F_0.06FeAs exposed to DC magnetic fields up to 10 kOe. The low- and high-frequency responses have been investigated by measuring the AC susceptibility at 100 kHz and the microwave surface resistance at 9.6 GHz. At low as well as high DC magnetic fields, the susceptibility strongly depends on the amplitude of the AC driving field, highlighting enhanced nonlinear effects. The field dependence of the AC susceptibility exhibits a magnetic hysteresis that can be justified considering the intragrain-field-penetration e…
We report resistivity and upper critical field B_c2(T) data for As deficient LaO_(0.9)F_(0.1)FeAs_(1-delta) in a wide temperature and high field range up to 60 T. These disordered samples exhibit a slightly enhanced superconducting transition at T_c = 29 K and a significantly enlarged slope dB_(c2))/dT = -5.4 T/K near T_c which contrasts with a flattening of B_(c2)(T) starting near 23 K above 30 T. This flattening is interpreted as Pauli limiting behaviour (PLB) with B_(c2)(0) approx 63 T. We compare our results with B_(c2)(T)-data reported in the literature for clean and disordered samples. W…
Based on first-principles FLAPW-GGA calculations, we have investigated the electronic structure of newly synthesized novel superconductors LaONiBi and LaOCuBi, the first bismuth-containing compounds from the family of quaternary oxypnictides which attract now a great deal of interest in search for novel 26-55K superconductors. The band structure, density of states and Fermi surfaces are discussed. Our results indicate that the bonding inside of the (La-O) and (Ni(Cu)-Bi) layers is covalent whereas the bonding between the (La-O) and (Ni(Cu)- Bi) blocks is mostly ionic. For both oxybismuthides, …
We have performed transverse-field muon spin relaxation (TF-$μ$SR) measurements on ambient-pressure-grown polycrystalline $\mathrm{LaO_{0.5}F_{0.5}BiS_{2}}$. From these measurements, no signature of magnetic order is found down to 25 mK. The value of the magnetic penetration depth extrapolated to 0 K is 0.89 (5) $μ$m. The temperature dependence of superconducting penetration depth is best described by either a multigap s + s-wave model with $Δ_{1}$ = 0.947 (7) meV and $Δ_{2}$ = 0.22 (4) meV or the ansiotropic s-wave model with $Δ(0)$ = 0.776 meV and anisotropic gap amplitude ratio $Δ_{min}/Δ_{…
Structural, electronic, and magnetic properties of undoped and aliovalent-ion (Ca, F)-doped LaOFeP, which undergo superconducting transitions at transition temperatures (Tc) 4-7 K [Kamihara et al, J. Am. Chem. Soc. 128, 10012, (2006)], were investigated. Tc of the samples varied from 2.4 to 5.5 K in the undoped samples, and was increased up to ~7 K by Ca- and F-doping. The Tc increases are correlated with a decrease in the lattice volume. LaOFeP exhibits paramagnetism in the normal conducting state. Photoemission spectroscopy combined with first-principle band calculations clarified that Fe 3d…
We report the temperature dependent x-ray powder diffraction of the FeAs-based superconductors in the range between 300 K and 95 K. In the case of NdOFeAs we have detected the structural phase transition from the tetragonal phase, with P4/nmm space group, to the orthorhombic phase,with Cmma space group, over a broad temperature range from 150 K to 120 K, centered at T0 137K. This transition is reduced, by about 30K, by the internal chemical pressure going from LaOFeAs to NdOFeAs. On the contrary the superconducting critical temperature increases from 27K to 51 K going from LaOFeAs to NdOFeAs d…
The occurrence of high temperature superconductivity, and the competition with magnetism, in stoichiometric and doped LaOFeAs and isostructural iron-oxypnictides is raising many fundamental questions about the electronic structure and magnetic interactions in this class of materials. There are now sufficient experimental data that it may be possible to identify the important issues whose resolution will lead to the understanding of this system. In this paper we address a number of the important issues. One important characteristic is the Fe-As distance (or more abstractly the pnictogen (Pn) he…
In high-transition temperature (high-Tc) copper oxides, it is generally believed that antiferromagnetism plays a fundamental role in the superconducting mechanism because superconductivity occurs when mobile electrons or holes are doped into the antiferromagnetic parent compounds. The recent discovery of superconductivity in the rare-earth (R) iron-based oxide systems [RO1-xFxFeAs] has generated enormous interest because these materials are the first noncopper oxide superconductors with Tc exceeding 50 K. The parent (nonsuperconducting) LaOFeAs material is metallic but shows anomalies near 150…
By first-principles calculations, we present a doping-dependent phase diagram of LaO{\it M}As ({\it M}=V--Cu) family. It is characterized as antiferromagnetic semiconductor around LaOMnAs side and ferromagnetic metal around LaOCoAs. Both LaOFeAs and LaONiAs, where superconductivity were discovered, are located at the borderline of magnetic phases. Extensive Fermi surface analysis suggests that the observed superconductivity is of electron-type in its origin. We discuss possible pairing mechanisms in the context of competing ferromagnetic phases found in this work and the ferromagnetic spin flu…
We report the synthesis and characterization of antimony doped oxypnictide superconductor, LaO0.8F0.2FeAs1-xSbx (x = 0.05 and 0.10). The parent compound LaOFeAs with fluorine doping exhibits superconductivity at maximum transition temperature ~ 28.5 K [11]. Here we partially substitute As by Sb (LaO0.8F0.2FeAs1-xSbx) and observe enhancement of the transition temperature to 30.1 K. This is the only instance so far where Tc increases with doping in the conducting layer (FeAs) and this leads to the highest transition temperature in any La-based oxypnictide. XRD and EDAX measurements confirm phase…
We present first principles calculations of the atomic and electronic structure of electron-doped LaOFeAs. We find that whereas the undoped compound has an antiferromagnetic arrangement of magnetic moments at the Fe atoms, the doped system becomes non magnetic at a critical electron concentration. We have studied the electron-phonon interaction in the doped paramagnetic phase. For the $A_{1g}$ phonon, the separation between the As and Fe planes induces a non-collinear arrangement of the Fe magnetic moments. This arrangement is anti parallel for interactions mediated by As, and perpendicular fo…
We have studied the reflectance of the recently discovered superconductor LaO_0.9F0.FeAs in a wide energy range from the far infrared to the visible regime. We report on the observation of infrared active phonons, the plasma edge (PE) and possible interband transitions. On the basis of this data and the reported in-plane penetration depth lambda_L(0) about 254 nm [H. Luetkens et al., Phys. Rev. Lett. v. 101, 0970009 (2008)] a disorder sensitive relatively small value of the total electron electron-boson coupling constant lambda_tot=lambda_e-ph+lambda_e-sp ~ 0.6 +- 0.35 can be estimated adoptin…
We discuss the electronic structure, lattice dynamics and electron-phonon interaction of newly discovered superconductor LaO$_{0.5}$F$_{0.5}$BiS$_{2}$ using density functional based calculations. A strong Fermi surface nesting at $\mathbf{k}$=($π$,$π$,0) suggests a proximity to charge density wave instability and leads to imaginary harmonic phonons at this $\mathbf{k}$ point associated with in-plane displacements of S atoms. Total energy analysis resolves only a shallow double-well potential well preventing the appearance of static long-range order. Both harmonic and anharmonic contributions t…
In this paper we report the fabrication and superconducting properties of GdO$_{1-x}$F$_{x}$FeAs. It is found that when x is equal to 0.17, GdO$_{0.83}$F$_{0.17}$FeAs is a superconductor with the onset transition temperature T$_{c}^{on}\approx$ 36.6K. Resistivity anomaly near 130K was observed for all samples up to x = 0.17, such a phenomenon is similar to that of LaO$_{1-x}$F$_{x}$FeAs. Hall coefficient indicates that GdO$_{0.83}$F$_{0.17}$FeAs is conducted by electron-like charge carriers.
From first-principles calculations, we have studied the electronic and magnetic structures of the ground state of LaOFeAs. The Fe spins are found to be collinear antiferromagnetic ordered, resulting from the interplay between the strong nearest and next-nearest neighbor superexchange antiferromagnetic interactions. The structure transition observed by neutron scattering is shown to be magnetically driven. Our study suggests that the antiferromagnetic fluctuation plays an important role in the Fe-based superconductors. This sheds light on the understanding of the pairing mechanism in these mate…
We report magnetization measurements of As-deficient LaO_0.9F_0.1FeAs_1-delta (delta about 0.06) samples with improved superconducting properties as compared with As-stoichiometric optimally doped La-1111 samples. In this As-deficient system with almost homogeneously distributed As-vacancies (AV), as suggested by the (75)As-nuclear quadrupole resonance (NQR) measurements,we observe a strong enhancement of the spin-susceptibility by a factor of 3-7. This observation is attributed to the presence of an electronically localized state around each AV, carrying a magnetic moment of about 3.2 mu_Bohr…
The significantly enhanced superconducting transition temperature ($T_c$) of an FeSe monolayer on SrTiO$_3$(001) substrate has attracted extensive attention in recent years. Here, based on first-principles electronic structure calculations, we propose another candidate substrate LaO(001) for the epitaxial growth of FeSe monolayer to realize superconductivity. Our calculations show that for the optimal adsorption structure of FeSe monolayer on LaO(001), the stripe antiferromagnetic state and the dimer antiferromagnetic state are almost energetically degenerate, indicating the existence of stron…
We report 139La, 57Fe and 75As nuclear magnetic resonance (NMR) and nuclear quadrupole resonance (NQR) measurements on powders of the new LaO1-xFxFeAs superconductor for x = 0 and x = 0.1 at temperatures up to 480 K, and compare our measured NQR spectra with local density approximation (LDA) calculations. For all three nuclei in the x = 0.1 material, it is found that the local Knight shift increases monotonically with an increase in temperature, and scales with the macroscopic susceptibility, suggesting a single magnetic degree of freedom. Surprisingly, the spin lattice relaxation rates for al…
In two recent articles (cond-mat/0606177 and arXiv:0804.1615), we have suggested a unified theory of superconductivity based on the real-space spin-parallel electron pairing and superconducting mechanism and have shown that the stable hexagonal and tetragonal vortex lattices (the optimal doping phases) can be expected in the newly discovered LaO{1-x}F{x}FeAs (x0=1/7=0.1428) and SmO{1-x}F{x}FeAs (x0=1/6=0.1667), respectively. In this paper, we present a theoretical study of the effects of hydrostatic and anisotropic pressure on the superconducting transition temperature Tc of the Fe-based layer…
The LAO/STO interface hosts a two-dimensional electron system that is unusually sensitive to the application of an in-plane magnetic field. Low-temperature experiments have revealed a giant negative magnetoresistance (dropping by 70\%), attributed to a magnetic-field induced transition between interacting phases of conduction electrons with Kondo-screened magnetic impurities. Here we report on experiments over a broad temperature range, showing the persistence of the magnetoresistance up to the 20~K range --- indicative of a single-particle mechanism. Motivated by a striking correspondence bet…
We have synthesized a quaternary fluoroarsenide SrFeAsF with the ZrCuSiAs-type structure (P4/nmm, a = 0.3999 and c = 0.8973 nm), which is composed of an alternately stacked (FeAs)- and (SrF)+ layers, analogous to the FeAs-based superconductor LaFeAsO. SrFeAsF shows metallic type conduction with the anomaly at ~180 K. The partial replacement of the Fe with Co suppresses the anomaly and induces the superconductivity, while the maximal Tc (4 K for SrFe0.875Co0.125AsF) is much lower than that of the Co-substituted LaFeAsO. Replacement of (LaO)+ layers with (SrF)+ layers results in a enlargement of…
The upper critical field $H_{c2}$ of polycrystalline samples of $Ln$O$_{0.5}$F$_{0.5}$BiS$_{2}$ ($Ln$ = La, Nd) at ambient pressure (tetragonal structure) and high pressure (HP) (monoclinic structure) have been investigated via electrical resistivity measurements at various magnetic fields up to 8.5 T. The $H_{c2}$($T$) curves for all the samples show an uncharacteristic concave upward curvature at temperatures below $T_c$, which cannot be described by the conventional one-band Werthamer-Helfand-Hohenberg theory. For the LaO$_{0.5}$F$_{0.5}$BiS$_{2}$ sample under HP, as temperature is decrease…
Since the discovery of high-Tc LaO_1-xF_xFeAs, and other such systems based on FeAs layers, several proposals have been made for the superconducting order parameter Delta_k, on both phenomenological and microscopic grounds. Here we discuss how the symmetry of Delta_k in the bulk can be determined, assuming that single crystals will soon be available. We suggest that a measurement of the dependence of the low temperature specific heat on the angle of a magnetic field in the FeAs plane is the simplest such method, and calculate representative specific heat vs. field angle oscillations for the va…
We report an angle-dependent study of the magnetic torque $τ(θ)$ within the vortex state of single-crystalline LaO$_{0.9}$F$_{0.1}$FeAs and SmO$_{0.9}$F$_{0.1}$FeAs as a function of both temperature $T$ and magnetic field $H$. Sharp peaks are observed at a critical angle $θ_c$ at either side of $θ=90^{\circ}$, where $θ$ is the angle between $H$ and the inter-planar \emph{c}-axis. $θ_c$ is interpreted as the critical depinning angle where the vortex lattice, pinned and locked by the intrinsic planar structure, unlocks and acquires a component perpendicular to the planes. We observe a series of …
Recent experiments have reported that inserting metal atoms or small molecules in between the FeSe layers of $β$-FeSe can significantly enhance the superconducting transition temperature. Here, based on first-principles electronic structure calculations, we propose a stable compound SnOFeSe by alternatively stacking the SnO and $β$-FeSe layers. The predicted SnOFeSe has the same tetragonal structure as the well-known FeAs-based compound LaOFeAs, meanwhile their electronic structures in the nonmagnetic state are quite similar. The magnetic ground state of SnOFeSe is predicted to be the dimer an…
Magnetic spin fluctuations is one candidate to produce the bosonic modes that mediate the superconductivity in the ferrous superconductors. Up until now, all of the LaOFeAs and BaFe2As2 structure types have simple commensurate magnetic ground states, as result of nesting Fermi surfaces. This type of spin-density-wave (SDW) magnetic order is known to be vulnerable to shifts in the Fermi surface when electronic densities are altered at the superconducting compositions. Superconductivity has more recently been discovered in alpha-Fe(Te,Se), whose electronically active antifluorite planes are isos…
The two-dimensional electron gas at the interface between LaAlO$_3$ and SrTiO$_3$ (LAO/STO) exhibits gate tunable superconductivity with a characteristic dome-like shape of the critical temperature ($T_c$) in the phase diagram. As shown recently [Phys. Rev. B 102, 085420 (2020)], such an effect can be explained as a consequence of the extended $s-$wave symmetry of the gap within an intersite real space pairing scenario, leading to a good agreement between the experiment and theory. In this work, we turn to a detailed analysis of the influence of spin-orbit coupling on the LAO/STO phase diagram…
High resolution angle-resolved photoemission measurements have been carried out on BaFe2As2, a parent compound of the FeAs-based superconductors. In the magnetic ordering state, there is no gap opening observed on the Fermi surface. Instead, dramatic band structure reorganization occurs across the magnetic transition. The appearance of the singular Fermi spots near (pi,pi) is the most prominent signature of magnetic ordering. These observations provide direct evidence that the magnetic ordering state of BaFe2As2 is distinct from the conventional spin-density-wave state. They reflect the electr…
The kinetic inductance properties of a thin superconducting sample of BSCCO-2223 compound is studied. A strong dependence of kinetic inductance with the variation of applied magnetic field is found at low temperature in the superconducting state. The kinetic inductance of a thin superconductor increases linearly with increasing magnetic field. This behavior is used for designing a superconducting modulator circuit. This behavior can be useful for device applications and designing of superconducting electronic circuits like superconducting power amplifier, superconducting transmitter and superc…
We present density functional theory (DFT) calculations and a full set of X-ray spectra (resonant inelastic X-ray scattering and X-ray photoelectron spectra) measurements of single crystal CaFe2As2. The experimental valence band spectra are consistent with our DFT calculations. Both theory and experiment show that the Fe 3d-states dominate the Fermi level and hybridize with Ca 3d-states. The simple shape of Xray photoelectron (XPS) Fe 2p-core level spectrum (without any satellite structure typical for correlated systems) suggests itinerant character of the Fe 3d-electrons. Based on the similar…
The discovery of about 50 K superconductivity in the tetragonal Fe-based pnictides has stimulated the search for superconductivity in a wide class of materials with similar structure. Copper forms compounds isostructural to LaOFeAs. Single phase BiOCuS can be prepared by a solid state reaction at temperature lower than 500 C from a mixture of Bi2O3, Bi2S3 and Cu2S. The samples have been characterized by means of EDX analysis, X-ray diffraction, magnetic and electrical measurements. The cell parameters are a = 3.8708 A, c = 8.565 A. Charge carrier doping can be realized either by F substitution…
We report experimental results of ^{75}As and ^{139}La nuclear magnetic resonance (NMR) in the iron-based layered La(O_{1-x}F_{x})FeAs (x= 0.0, 0.04 and 0.11) system. In the undoped LaOFeAs, 1/T_1 of ^{139}La exhibits a distinct peak at T_N ~ 142 K below which the spectra become broadened due to the internal magnetic field attributed to an antiferromagnetic (AFM) ordering. In the 4% F-doped sample, 1/T_1T exhibits a Curie-Weiss temperature dependence down to 30 K, suggesting the development of AFM spin fluctuations with decreasing temperature. In the 11% F-doped sample, in contrast, pseudogap …
We study inelastic (dynamical) impurity scattering effects in two-band superconductors with the same ($s_{++}$ wave) or different ($s_\pm$ wave) sign order parameters. We focus on the enhancement of the superconducting transition temperature $T_{\rm c}$ by magnetic interband scattering with the interchange of crystal-field singlet ground and multiplet excited states. Either the $s_{++}$-wave or $s_\pm$-wave state is favored by the impurity-mediated pairing, which depends on the magnetic and nonmagnetic scattering strengths derived from the hybridization of the impurity states with the conducti…
