Neutron diffraction and high-resolution x-ray diffraction studies find that, similar to the closely related underdoped Ba(Fe[1-x]Cox)2As2 superconducting compounds, Ba(Fe0.961Rh0.039)2As2 shows strong evidence of competition and coexistence between superconductivity and antiferromagnetic order below the superconducting transition, Tc = 14 K. The transition temperatures for both the magnetic order and orthorhombic distortion are in excellent agreement with those inferred from resistivity measurements, and both order parameters manifest a distinct decrease in magnitude below Tc. These data suggest that the strong interaction between magnetism and superconductivity is a general feature of electron-doped Ba(Fe[1-x]TMx)2As2 superconductors (TM = Transition Metal).
High-resolution x-ray diffraction measurements reveal an unusually strong response of the lattice to superconductivity in Ba[Fe(1-x)Cox]2As2. The orthorhombic distortion of the lattice is suppressed and, for Co-doping near x = 0.063, the orthorhombic structure evolves smoothly back to a tetragonal structure. We propose that the coupling between orthorhombicity and superconductivity is indirect and arises due to the magneto-elastic coupling, in the form of emergent nematic order, and the strong competition between magnetism and superconductivity.
Neutron powder diffraction experiments were carried out on polycrystalline SrFe$_2$As$_2$ in order to determine the magnetic structure and its relationship with the crystallographic one. Below $T_0$=205 K, magnetic reflections appear simultaneously with the onset of the orthorhombic distortion. From a detailed Rietveld analysis, the magnetic propagation vector of SrFe$_2$As$_2$ is determined to be {\textit{\textbf{q}}}=(1 0 1); the coupling of Fe moments is antiferromagnetic along the longer $a$ direction within the Fe-As layer, and the interlayer coupling is antiferromagnetic as well. The siz…
We investigated the in-plane resistivity anisotropy for underdoped Ba(Fe$_{1-x}$Co$_x$)$_2$As$_2$ single crystals with improved quality. We demonstrate that the anisotropy in resistivity in the magnetostructural ordered phase arises from the anisotropy in the residual component which increases in proportion to the Co concentration $x$. This gives evidence that the anisotropy originates from the impurity scattering by Co atoms substituted for the Fe sites, rather than so far proposed mechanism such as the anisotropy of Fermi velocities of reconstructed Fermi surface pockets. As doping proceeds …
Neutron diffraction experiments have been carried out on a Sn-flux grown BaFe2As2 single crystal, the parent compound of the A-122 family of FeAs-based high-Tc superconductors. A tetragonal to orthorhombic structural phase transition and a three dimensional long-range antiferromagnetic ordering of the iron moment, with a unique magnetic propagation wavevector k = (1, 0, 1), have been found to take place at ~90 K. The magnetic moments of iron are aligned along the long a axis in the low temperature orthorhombic phase (Fmmm with b<a<c). Our results thus demonstrate that the magnetic structure of…
The symmetry of the Bloch functions in the conduction band of tetragonal and orthorhombic La_2CuO_4 is examined for the existence of symmetry-adapted and optimally localizable (usual or spin-dependent) Wannier functions. It turns out that such Wannier functions do not exist in the tetragonal phase. In the orthorhombic phase, on the other hand, the Bloch functions can be unitarily transformed in three different ways into optimally localizable Wannier functions: they can be chosen to be adapted to each of the three phases observed in the pure or doped material, that is, to the antiferromagnetic …
We use neutron scattering to study the structural distortion and antiferromagnetic (AFM) order in LaFeAsO$_{1-x}$F$_{x}$ as the system is doped with fluorine (F) to induce superconductivity. In the undoped state, LaFeAsO exhibits a structural distortion, changing the symmetry from tetragonal (space group $P4/nmm$) to orthorhombic (space group $Cmma$) at 155 K, and then followed by an AFM order at 137 K. Doping the system with F gradually decreases the structural distortion temperature, but suppresses the long range AFM order before the emergence of superconductivity. Therefore, while supercond…
We have studied the anisotropy in the in-plane resistivity and the electronic structure of isovalent Ru-substituted BaFe$_2$As$_2$ in the antiferromagnetic-orthorhombic phase using well-annealed crystals. The anisotropy in the residual resistivity component increases in proportional to the Ru dopant concentration, as in the case of Co-doped compounds. On the other hand, both the residual resistivity and the resistivity anisotropy induced by isovalent Ru substitution is found to be one order of magnitude smaller than those induced by heterovalent Co substitution. Combined with angle-resolved ph…
We use transport and inelastic neutron scattering measurements to investigate single crystals of iron pnictide BaFe$_{2-x}$Ni$_{x}$As$_{2}$ ($x=0,0.03$), which exhibit a tetragonal-to-orthorhombic structural transition at $T_s$ and stripe antiferromagnetic order at $T_N$ ($T_s\geq T_N$). Using a tunable uniaxial pressure device, we detwin the crystals and study their transport and spin excitation properties at antiferromagnetic wave vector $S_1(1,0)$ and its 90$^\circ$ rotated wave vector $S_2(0,1)$ under different pressure conditions. We find that uniaxial pressure necessary to detwin and mai…
We report a La2CuO4-like interlayer antiferromagnetic order in Sr2IrO4 films with large orthorhombic distortion (> 1.5%). The biaxial lattice strain in epitaxial heterostructures of Sr2IrO4/Ca3Ru2O7 lowers the crystal symmetry of Sr2IrO4 from tetragonal (C4) to orthorhombic (C2), guiding the Ir 5d Jeff = 1/2 pseudospin moment parallel to the elongated b-axis via magnetic anisotropy. From resonant X-ray scattering experiments, we observed an antiferromagnetic order in the orthorhombic Sr2IrO4 film whose interlayer stacking pattern is inverted from that of the tetragonal Sr2IrO4 crystal. This in…
We present neutron scattering data on two single crystals of the high temperature superconductor La2-x(Ca,Sr)xCaCu2O6+delta. The Ca0.1-doped crystal exhibits a long-range antiferromagnetically ordered ground state. In contrast, the Sr0.15-doped crystal exhibits short-range antiferromagnetic order as well as weak superconductivity. In both crystals antiferromagnetic correlations are commensurate; however, some results on the Ca0.1-doped crystal resemble those on the spin-glass phase of La2-xSrxCuO4, where magnetic correlations became incommensurate. In addition, both crystals show a structural …
Neutron and x-ray diffraction studies of Ba(Fe{1-x}Mn{x})2As2 for low doping concentrations (x <= 0.176) reveal that at a critical concentration, 0.102 < x < 0.118, the tetragonal-to-orthorhombic transition abruptly disappears whereas magnetic ordering with a propagation vector of (1/2 1/2 1) persists. Among all of the iron arsenides this observation is unique to Mn-doping, and unexpected because all models for "stripe-like" antiferromagnetic order anticipate an attendant orthorhombic distortion due to magnetoelastic effects. We discuss these observations and their consequences in terms of pre…
Inelastic neutron scattering measurements of CaFe2As2 under applied hydrostatic pressure show that the antiferromagnetic spin fluctuations observed in the ambient pressure, paramagnetic, tetragonal (T) phase are strongly suppressed, if not absent, in the collapsed tetragonal (cT) phase. These results are consistent with a quenched Fe moment in the cT phase and the strong decrease in resistivity observed upon crossing the boundary from the T to cT phase. The suppression or absence of static antiferromagnetic order and dynamic spin fluctuations in the non-superconducting cT phase supports the no…
We have found a remarkably large response of the transition temperature of CaFe2As2 single crystals grown out of excess FeAs to annealing / quenching temperature. Whereas crystals that are annealed at 400 C exhibit a first order phase transition from a high temperature tetragonal to a low temperature orthorhombic and antiferromagnetic state near 170 K, crystals that have been quenched from 960 C exhibit a transition from a high temperature tetragonal phase to a low temperature, non-magnetic, collapsed tetragonal phase below 100 K. By use of temperature dependent electrical resistivity, magneti…
Low-temperature (22~K) irradiation with 2.5~MeV electrons was used to study the competition between stripe ${\rm C_2}$ and tetragonal ${\rm C_4}$ antiferromagnetic phases which exist in a narrow doping range around $x=$0.25 in hole-doped Ba$_{1-x}$K$_x$Fe$_2$As$_2$. In nearby compositions outside of this range, at $x=$0.22 and $x=$0.19, the temperatures of both the concomitant orthorhombic/stripe antiferromagnetic transition $T_{\rm C2}$ and the superconducting transition $T_{\rm c}$ are monotonically suppressed by added disorder at similar rates of about 0.1~K/$μΩ$cm, as revealed through usin…
We have combined elastic and inelastic neutron scattering techniques, magnetic susceptibility and resistivity measurements to study single-crystal samples of K$_x$Fe$_{2-y}$Se$_2$, which contain the superconducting phase that has a transition temperature of $\sim$31 K. In the inelastic neutron scattering measurements, we observe both the spin-wave excitations resulting from the block antiferromagnetic ordered phase and the resonance that is associated with the superconductivity in the superconducting phase, demonstrating the coexistence of these two orders. From the temperature dependence of t…
Generally strong charge and magnetic inhomogeneities are observed in NQR/NMR experiments on underdoped cuprates. It is not the case for the underdoped HgBa$_2$CuO$_{4+δ}$, the most symmetric and highest T$_c$ single layer cuprate, whose magnetic inhomogeneity is strongly suppressed. Also neutron scattering experiments reveal a unique pair of weakly dispersive magnetic modes in this material. We propose that these special properties stem from the symmetric positioning of the O-dopants between adjacent CuO$_2$ layers that lead to a strong superexchange interaction between a pair of hole spins. I…
We suggest that Cobalt-Oxychalcogenide layers constructed by vertex sharing CoA$_2$O$_2$ (A=S,Se,Te) tetrahedra, such as BaCoAO, are strongly correlated multi-orbital electron systems that can provide important clues on the cause of unconventional superconductivity. Differing from cuprates and iron-based superconductors, these systems lack of the C$_4$ rotational symmetry. However, their parental compounds possess antiferromagnetic(AFM) Mott insulating states through pure superexchange interactions and the low energy physics near Fermi surfaces upon doping is also attributed mainly to the thre…
We studied the effects of nonmagnetic impurities on high-temperature superconductors by solving the Bogoliubov-de Gennes equations on a two-dimensional lattice via exact diagonalization technique in a fully self-consistent way. We found that s-wave order parameter is almost unaffected by impurities at low concentrations while $d_{x^2-y^2}$-wave order parameter exhibits a strong linear decrease with impurity concentration. We evaluated the critical impurity concentration $n_i^c$ at which superconductivity ceases to be 0.1 which is in good agreement with experimental values. We also investigated…
We report that the pressure-temperature phase diagram of single-crystalline SrFe$_2$As$_2$ is easily affected by the hydrostaticity of a pressure-transmitting medium. For all of the three mediums we used, superconductivity with zero resistance appears, accompanied by the suppression of an antiferromagnetic (orthorhombic) phase, but the critical pressure $P_c$ was found to depend on the type of medium. $P_c$ was estimated to be 4.4 GPa under almost hydrostatic condition, but it decreased to $3.4-3.7$ GPa with the use of the medium already solidified at room temperature. The uniaxial stress alon…
We have used high-resolution neutron Larmor diffraction and capacitative dilatometry to investigate spontaneous and forced magnetostriction in undoped, antiferromagnetic YBa$_2$Cu$_3$O$_{6.0}$, the parent compound of a prominent family of high-temperature superconductors. Upon cooling below the Néel temperature, $T_N = 420$~K, Larmor diffraction reveals the formation of magneto-structural domains of characteristic size $\sim 240$~nm. In the antiferromagnetic state, dilatometry reveals a minute ($4 \times 10^{-6}$) orthorhombic distortion of the crystal lattice in external magnetic fields. We a…
Synchrotron x-ray diffraction experiments were performed on BaFe$_2$As$_2$ and Sr(Fe$_{1-x}$Co$_{x}$)$_2$As$_2$ single crystals as a function of temperature and applied magnetic field along the tetragonal $[1 \bar{1} 0]$ direction, complemented by electrical resistivity and specific heat experiments. For a BaFe$_2$As$_2$ crystal with spin-density-wave antiferromagnetic ordering temperature $T_{AF}=132.5$ K and onset of the orthorhombic phase at $T_{o}=137$ K, the magnetic field favors the growth of tetragonal domains that compete with orthorhombic ones for $T \gtrsim T_{AF}$. For a Sr(Fe$_{1-x…
As reported by Q. Huang et al. [Phys. Rev. Lett. 101, 257003 (2008)], neutron diffraction studies show an onset of antiferromagnetic order in BaFe2As2 associated with a tetragonal-to-orthorhombic distortion. We determine the group Cmca as the space group of antiferromagnetic BaFe2As2 and identify a roughly half-filled energy band of BaFe2As2 with Bloch functions of special symmetry as magnetic band. As explained by the group-theoretical nonadiabatic Heisenberg model, the electrons in this narrow band may lower their Coulomb correlation energy by producing just the experimentally observed antif…
$^{75}$As and $^{139}$La NMR results of LaFeAs(O$_{1-x}$F$_x$) ($x$=0, 0.025, and 0.04) were reported. Upon F-doping, the tetragonal-to-orthorhombic structural phase transition temperature $T_S$, antiferromagnetic transition temperature $T_N$ and internal magnetic field $μ_0H_{\rm int}$ are gradually reduced for $x<0.04$. However, at $x=0.04$, $T_N$ is abruptly suppressed to be 30 K along with a tiny $μ_0H_{\rm int}$, which is distinct from the continuous disappearance of the ordered phases in the Ba122 systems of Ba(Fe,Co)$_2$As$_2$ and BaFe$_2$(As,P)$_2$. The anisotropy of the spin-lattice r…
Understanding the interplay between nematicity, magnetism and superconductivity is pivotal for elucidating the physics of iron-based superconductors. Here we use neutron scattering to probe magnetic and nematic orders throughout the phase diagram of NaFe$_{1-x}$Ni$_x$As, finding that while both static antiferromagnetic and nematic orders compete with superconductivity, the onset temperatures for these two orders remain well-separated approaching the putative quantum critical points. We uncover local orthorhombic distortions that persist well above the tetragonal-to-orthorhombic structural tran…
Interplay of stripe and double-Q magnetism with superconductivity in $\mathrm{Ba}_{1-x}\mathrm{K}_{x}\mathrm{Fe}_{2}\mathrm{As}_{2}$ under the influence of magnetic fields
The antiferromagnet CaFe$_2$As$_2$ does not become superconducting when subject to ideal hydrostatic pressure conditions, where crystallographic and magnetic states also are well defined. By measuring electrical resistivity and magnetic susceptibility under quasi-hydrostatic pressure, however, we find that a substantial volume fraction of the sample is superconducting in a narrow pressure range where collapsed tetragonal and orthorhombic structures coexist. At higher pressures, the collapsed tetragonal structure is stabilized, with the boundary between this structure and the phase of coexistin…
Starting from the orthorhombic magnetically ordered phase, we investigate the effects of uniaxial tensile and compressive stresses along a, b, and the diagonal a+b directions in BaFe2As2 and CaFe2As2 in the framework of ab initio density functional theory (DFT) and a phenomonological Ginzburg-Landau model. While -contrary to the application of hydrostatic or c-axis uniaxial pressure- both systems remain in the orthorhombic phase with a pressure-dependent nonzero magnetic moment, we observe a sign-changing jump in the orthorhombicity at a critical uniaxial pressure, accompanied by a reversal of…
Neutron diffraction measurements are presented measuring the responses of both magnetic and structural order parameters of parent and lightly Co-doped Ba(Fe{1-x}Co{x})2As2 under the application of uniaxial pressure. We find that the uniaxial pressure induces a thermal shift in the onset of antiferromagnetic order that grows as a percentage of T_N as Co-doping is increased and the superconducting phase is approached. Additionally, as uniaxial pressure is increased within parent and lightly-doped Ba(Fe{1-x}Co{x})2As2 on the first order side of the tricritical point, we observe a decoupling betwe…
We undertake a detailed high-resolution diffraction study of a novel plain band insulator, La$_2$MgO$_4$, which may be viewed as a structural surrogate system of the undoped end-member of the high-T$_c$ superconductors, La$_{2-x-y}$A$^{2+}_x$RE$^{3+}_y$CuO$_{4}$ (A = Ba, Sr, RE= Rare Earth). We find that La$_2$MgO$_4$ exhibits the infamous low-temperature orthorhombic (LTO) to low-temperature tetragonal (LTT) phase transition that has been linked to the suppression of superconductivity in a variety of underdoped cuprates, including the well known La$_{2-x}$Ba$_{x}$CuO$_4$ ($x=0.125$). Furtherm…
Neutron and x-ray diffraction studies show that the simultaneous first-order transition to an orthorhombic and antiferromagnetic (AFM) ordered state in BaFe2As2 splits into two transitions with Co doping. For Ba(Fe0.953Co0.047)2As2, a tetragonal-orthorhombic transition occurs at TS = 60 K, followed by a second-order transition to AFM order at TN = 47 K. Superconductivity (SC) occurs in the orthorhombic state below TC = 15 K and coexists with AFM. Below TC, the static Fe moment is reduced and a 4 meV spin gap develops indicating competition between coexisting SC and AFM order.
As experimentally well established, undoped LaFeAsO is antiferromagnetic below 137K with the magnetic moments lying on the Fe sites. We determine the orthorhombic body-centered group Imma (74) as the space group of the experimentally observed magnetic structure in the undistorted lattice, i.e., in a lattice possessing no structural distortions in addition to the magnetostriction. We show that LaFeAsO possesses a partly filled "magnetic band" with Bloch functions that can be unitarily transformed into optimally localized Wannier functions adapted to the space group Imma. This finding is interpr…
We have grown single crystal samples of Co substituted CaFe2As2 using an FeAs flux and systematically studied the effects of annealing/quenching temperature on the physical properties of these samples. Whereas the as-grown samples (quenched from 960C) all enter the collapsed tetragonal phase upon cooling, annealing/quenching temperatures between 350C and 800C can be used to tune the system to low temperature antiferromagnetic/orthorhomic or superconducting states as well. The progression of the transition temperature versus annealing/quenching temperature (T-T$_{anneal}$) phase diagrams with i…
We use polarized neutron scattering to demonstrate that in-plane spin excitations in electron doped superconducting BaFe1.904Ni0.096As2 (Tc=19.8 K) change from isotropic to anisotropic in the tetragonal phase well above the antiferromagnetic (AF) ordering and tetragonal-to-orthorhombic lattice distortion temperatures (Tn=Ts=33 K) without an uniaxial pressure. While the anisotropic spin excitations are not sensitive to the AF order and tetragonal-to-orthorhombic lattice distortion, superconductivity induces further anisotropy for spin excitations along the [1,1,0] and [1,-1,0] directions. These…
Understanding the nature of the electronic nematic phase in iron pnictide superconductors is important for elucidating its impact on high-temperature superconductivity. Here we use transport and inelastic neutron scattering to study spin excitations and in-plane resistivity anisotropy in uniaxial pressure detwinned BaFe$_2$As$_2$ and SrFe$_2$As$_2$, the parent compounds of iron pnictide superconductors. While BaFe$_2$As$_2$ exhibits weakly first order tetragonal-to-orthorhombic structural and antiferromagnetic (AF) phase transitions below $T_s > T_N\approx 138$ K, SrFe$_2$As$_2$ has strongly c…
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 …
Coexistence of Antiferromagnetic Spin Fluctuations and Superconductivity in La2SmNi2O7 Thin Films
ShanghaiTech University（上海科技大学）；Shanghai Advanced Research Institute, Chinese Academy of Sciences（中国科学院上海高等研究院）；Institute of Physics, Chinese Academy of Sciences（中国科学院物理研究所）；University of Chinese Academy of Sciences（中国科学院大学）
We use neutron polarization analysis to study temperature dependence of the spin excitation anisotropy in BaFe$_2$As$_2$, which has a tetragonal-to-orthorhombic structural distortion at $T_s$ and antiferromagnetic (AF) phase transition at $T_N$ with ordered moments along the orthorhombic $a$-axis below $T_s\approx T_N\approx 136$ K. In the paramagnetic tetragonal state at 160 K, spin excitations are isotropic in spin space with $M_a=M_b=M_c$, where $M_a$, $M_b$, and $M_c$ are spin excitations polarized along the $a$, $b$, and $c$-axis directions of the orthorhombic lattice, respectively. On co…
We study the superconducting instability mediated by spin fluctuations in the Eliashberg theory for a minimal two-band model of iron-based superconductors. While antiferromagnetic spin fluctuations can drive superconductivity (SC) as is well established, we find that spin fluctuations necessarily contain a contribution to suppress SC even though SC can eventually occur at lower temperatures. This self-restraint effect stems from a general feature of the spin-fluctuation mechanism, namely the repulsive pairing interaction, which leads to phase frustration of the pairing gap and consequently the…
The in-plane anisotropy of the electrical resistivity across the coupled orthorhombic and magnetic transitions of the iron pnictides has been extensively studied in the parent and electron-doped compounds. All these studies universally show that the resistivity $ρ_{a}$ across the long orthorhombic axis $a_{O}$ - along which the spins couple antiferromagnetically below the magnetic transition temperature - is smaller than the resistivity $ρ_{b}$ of the short orthorhombic axis $b_{O}$, i. e. $ρ_{a}<ρ_{b}$. Here we report that in the hole-doped compounds Ba$_{1-x}$K$_{x}$Fe$_{2}$As$_{2}$, as 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}$ undergoes a spin-density-wave (SDW) transition associated with Fe moments at 195 K, followed by antiferromagnetic (AFM) ordering of Eu$^{2+}$ moments at 20 K. Ni doping at the Fe site simultaneously suppresses the SDW transition and AFM ordering of Eu$^{2+}$ moments. For $x\geq$0.06, the magnetic ordering of Eu$^{2+}$ moments evolves from antiferromagnetic to f…
We study superconducting FeSe (Tc = 9 K) exhibiting the tetragonal-orthorhombic structural transition (Ts = 90 K) without any antiferromagnetic ordering, by utilizing angle-resolved photoemission spectroscopy. In the detwinned orthorhombic state, the energy position of the dyz orbital band at the Brillouin zone corner is 50 meV higher than that of dxz, indicating the orbital order similar to NaFeAs and BaFe2As2 families. Evidence of orbital order also appears in the hole bands at the Brillouin zone center. Precisely measured temperature dependence using strain-free samples shows that the onset…
In the hole-doped cuprates, a small amount of carriers suppresses antiferromagnetism and induces superconductivity. In the electron-doped cuprates, on the other hand, superconductivity appears only in a narrow range of high electron concentration ($\sim$ doped Ce content) after reduction annealing, and strong antiferromagnetic (AFM) correlation persists in the superconducting phase. Recently, Pr$_{1.3-x}$La$_{0.7}$Ce$_{x}$CuO$_{4}$ (PLCCO) bulk single crystals annealed by a "protect annealing" method showed a high $T_c$ of $\sim$ 27 K for small Ce content down to $x \sim 0.05$. By angle-resolv…
Polarized inelastic neutron scattering experiments were performed to study magnetic excitations in the normal and superconducting phases of Co-underdoped BaFe$_2$As$_2$, which exhibits coexistence of antiferromagnetic order and superconductivity. In the normal state the antiferromagnetic order results in broadened spin gaps opening in all three spin directions that are reminiscent of the magnetic response in pure antiferromagnetic BaFe$_2$As$_2$. In particular longitudinal excitations exhibit a large gap. In the superconducting state we find two distinct resonance excitations, which both are a…
The magnetic ordering and crystal structure of iron pnictide SrFeAsF was investigated by using neutron powder diffraction method. With decreasing temperature, the tetragonal to orthorhombic phase transition is found at 180 K, while the paramagnetic to antiferromagnetic phase transition set in at 133 K. Similar to the parent compound of other iron pnictide system, the striped Fe magnetism is confirmed in antiferromagnetic phase and the Fe moment of 0.58(6) uB aligned along long a axis. The thermal expansion of orthorhombic phase of SrFeAsF is also investigated. Based on the Grueneisen approxima…
A Neutron Powder Diffraction (NPD) experiment has been performed to investigate the structural phase transition and magnetic order in CaFe1-xCoxAsF superconductor compounds (x = 0, 0.06, 0.12). The parent compound CaFeAsF undergoes a tetragonal to orthorhombic phase transition at 134(3) K, while the magnetic order in form of a spin-density wave (SDW) sets in at 114(3) K. The antiferromagnetic structure of the parent compound has been determined with a unique propagation vector k = (1,0,1) and the Fe saturation moment of 0.49(5)uB aligned along the long a-axis. With increasing Co doping, the lo…
We review neutron scattering investigations of the crystal structures, magnetic structures, and spin dynamics of the iron-based RFe(As,P)O (R=La, Ce, Pr, Nd), (Ba,Sr,Ca)Fe2As2, and Fe1+x(Te-Se) systems. On cooling from room temperature all the undoped materials exhibit universal behavior, where a tetragonal-to-orthorhombic/monoclinic structural transition occurs, below which the systems become antiferromagnets. For the first two classes of materials the magnetic structure within the a-b plane consists of chains of parallel Fe spins that are coupled antiferromagnetically in the orthogonal direc…
The low-temperature crystal structure of Fe1.13Te, which exhibits an anomalous two-step magnetic transition, was clarified by the systematic x-ray diffraction measurements. It was found that two-step structural phase transition, tetragonal-orthorhombic-monoclinic, occurred correspondingly to the two-step magnetic transition. The detailed analysis of the profile at 5 K indicated the coexistence of the minor orthorhombic area inside the major monoclinic lattice, which could explain the lower-shift (suppression) of the antiferromagnetic transition temperature in Fe1.13Te and suggest a possibility…
Magnetization, neutron diffraction, and high-energy x-ray diffraction results for Sn-flux grown single-crystal samples of Ca(Co$_{1-x}$Fe$_{x}$)$_{y}$As$_{2}$, $0\leq x\leq1$, $1.86\leq y \leq 2$, are presented and reveal that A-type antiferromagnetic order, with ordered moments lying along the $c$ axis, persists for $x\lesssim0.12(1)$. The antiferromagnetic order is smoothly suppressed with increasing $x$, with both the ordered moment and Néel temperature linearly decreasing. Stripe-type antiferromagnetic order does not occur for $x\leq0.25$, nor does ferromagnetic order for $x$ up to at leas…
Ca10(Pt3As8)(Fe2As2)5 is the parent compound for a class of Fe-based high-temperature superconductors where superconductivity with transition temperatures up to 30 K can be introduced by partial element substitution. We present a combined high-resolution high-energy x-ray diffraction and elastic neutron scattering study on a Ca10(Pt3As8)(Fe2As2)5 single crystal. This study reveals the microscopic nature of two distinct and continuous phase transitions to be very similar to other Fe-based high-temperature superconductors: an orthorhombic distortion of the high-temperature tetragonal Fe-As latti…
We report the synthesis and characterization of the novel silicide LaFeSiH displaying superconductivity with onset at 11 K. We find that this pnictogen-free compound is isostructural to LaFeAsO, with a similar low-temperature tetragonal to orthorhombic distortion. Using density functional theory we show that this system is also a multiband metal in which the orthorhombic distortion is likely related to single-stripe antiferromagnetic order. Electrical resistivity and magnetic susceptibility measurements reveal that these features occur side-by-side with superconductivity, which is suppressed b…
We investigate the 16-band d-p model for iron pnictide superconductors in the presence of the electron-phonon coupling g with the orthorhombic mode which is crucial for reproducing the recently observed ultrasonic softening. Within the RPA, we obtain the ferro-orbital order below TQ which induces the tetragonal-orthorhombic structural transition at Ts = TQ, together with the stripe-type antiferromagnetic order below TN. Near the phase transitions, the system shows the s++ wave superconductivity due to the orbital fluctuation for a large g case with TQ > TN, while the s+- wave due to the magnet…
We use neutron resonance spin echo and Larmor diffraction to study the effect of uniaxial pressure on the tetragonal-to-orthorhombic structural ($T_s$) and antiferromagnetic (AF) phase transitions in iron pnictides BaFe$_{2-x}$Ni$_{x}$As$_{2}$ ($x=0,0.03,0.12$), SrFe$_{1.97}$Ni$_{0.03}$As$_2$, and BaFe$_2$(As$_{0.7}$P$_{0.3}$)$_2$. In antiferromagnetically ordered BaFe$_{2-x}$Ni$_{x}$As$_{2}$ and SrFe$_{1.97}$Ni$_{0.03}$As$_2$ with $T_N$ and $T_s$ ($T_N\leq T_s$), a uniaxial pressure necessary to detwin the sample also increases $T_N$, smears out the structural transition, and induces an ortho…
Superconductivity in BaFe2(As1-xPx)2 iron pnictides emerges when its in-plane two-dimensional (2D) orthorhombic lattice distortion associated with nematic phase at Ts and three-dimensional (3D) collinear antiferromagnetic (AF) order at TN (Ts = TN) are gradually suppressed with increasing x, reaching optimal superconductivity around x = 0.30 with Tc $\approx$ 30 K. Here we show that a moderate uniaxial pressure along the c-axis in BaFe2(As0.70P0.30)2 spontaneously induces a 3D collinear AF order with TN = Ts > 30 K, while only slightly suppresses Tc. Although a ~ 400 MPa pressure compresses th…
In iron-based superconductors, high critical temperature (Tc) superconductivity over 50 K has only been accomplished in electron-doped hREFeAsO (hRE = heavy rare earth (RE) element). While hREFeAsO has the highest bulk Tc (58 K), progress in understanding its physical properties has been relatively slow due to difficulties in achieving high concentration electron-doping and carrying out neutron-experiments. Here, we present a systematic neutron powder diffraction (NPD) study of 154SmFeAsO1-xDx, and the discovery of a new long-range antiferromagnetic ordering with x >= 0.56 (AFM2) accompanying …
We study the antiferromagnetic (AFM) and structural phase transitions in single crystal $BaFe_2(As_{1-x}P_x)_2$ $(x=0, 0.3)$ at temperatures $T_N$ and $T_S$, respectively, by high resolution ac microcalorimetry and SQUID magnetometry. The specific heat measurements of both as grown and annealed $BaFe_2As_2$ displays a sharp peak at the AFM/Structural transitions. A kink in the entropy of annealed $BaFe_2As_2$ gives evidence for splitting of the two transitions by approximately 0.5K. No additional features could be identified in the specific heat of both $BaFe_2As_2$ and $BaFe_2(As_{0.7}P_{0.3}…
The crystal structure and electrical resistivity of YBa$_2$Cu$_4$O$_8$ (Y124) were studied under high pressure up to 18 GPa using diamond-anvil cells, respectively, in order to clarify its conduction mechanism. Y124 causes the first-order phase-transition into the orthorhombic Immm at pressure around 11 GPa. The high-pressure phase (HPP) also shows the superconductivity, while the manner of temperature dependence of electrical resistance and the pressure dependence of transition temperature, Tc, drastically change above 11 GPa. The CuO$_2$ plane persists in HPP but the CuO double chains collap…
