We investigated the iron-based ladder compounds (Ba,Cs)Fe$_2$Se$_3$. Their parent compounds, BaFe$_2$Se$_3$ and CsFe$_2$Se$_3$, have different space groups, formal valences of Fe and magnetic structures. Electrical resistivity, specific heat, magnetic susceptibility, X-ray diffraction and powder neutron diffraction measurements were conducted to obtain temperature and composition phase diagram of this system. Block magnetism observed in BaFe$_2$Se$_3$ is drastically suppressed with Cs doping. In contrast, stripe magnetism observed in CsFe$_2$Se$_3$ is not so fragile against Ba doping. New type of magnetic structure appears in intermediate compositions, which is similar to stripe magnetism of CsFe$_2$Se$_3$, but inter-ladder spin configuration is different. Intermediate compounds show insulating behavior, nevertheless finite $T$-linear contribution in specific heat was obtained at low temperatures.
Since the discovery of pressure-induced superconductivity in the two-leg ladder system BaFe$_2X_3$ ($X$=S, Se), with the 3$d$ iron electronic density $n = 6$, the quasi-one-dimensional iron-based ladders have attracted considerable attention. Here, we use Density Functional Theory (DFT) to predict that the novel $n = 6$ iron ladder BaFe$_2$Te$_3$ could be stable with a similar crystal structure as BaFe$_2$Se$_3$. Our results also indicate that BaFe$_2$Te$_3$ will display the complex 2$\times$2 Block-type magnetic order. Due to the magnetic striction effects of this Block order, BaFe$_2$Te$_3$ …
The recent discovery of superconductivity under high pressure in the two-leg ladder compound BaFe$_2$S$_3$ [H. Takahashi et al., Nature Materials 14, 1008 (2015)] opens a broad avenue of research, because it represents the first report of pairing tendencies in a quasi one-dimensional iron-based high critical temperature superconductor. Similarly as in the case of the cuprates, ladders and chains can be far more accurately studied using many-body techniques and model Hamiltonians than their layered counterparts, particularly if several orbitals are active. In this publication, we derive a two-o…
The recent discovery of superconductivity at high pressure in the two-leg ladder compounds BaFe$_2X_3$ ($X$=S, Se) started the novel field of quasi-one-dimensional iron-based superconductors. In this publication, we use Density Functional Theory (DFT) to predict that the previously barely explored ladder compound RbFe$_2$Te$_3$ should be magnetic with a CX-type arrangement involving ferromagnetic rungs and antiferromagnetic legs, at the realistic density of $n=5.5$ electrons per iron. The magnetic state similarity with BaFe$_2$S$_3$ suggests that RbFe$_2$Te$_3$ could also become superconductin…
This response on a Comment on Reference 2 discusses the space group Fmm2 determination of the low temperature structure of NaV2O5. We show that while conventional crystallography is consistent with 'zig-zag' charge ordering of half of the ladders, recent spectroscopic measurements suggest that the symmetry is lower than Fmm2. We suggest space group C2, consistent with full 'zig-zag' charge ordering of all the ladders.
Spin-ladder compounds make interesting analogs of the high-temperature superconductors, because they contain layers of nearly one-dimensional "ladders" consisting of a square array of copper and oxygen atoms. Increasing the number of legs in the ladders provides a step-wise approach toward the two-dimensional copper-oxygen plane, that structure believed to be a key to high temperature superconductivity. Short-range spin correlations in ladders have been predicted to lead to formation of hole pairs favorable for superconductivity, once enough holes are introduced onto the ladders by doping. Ind…
We studied the effects of the incommensurate structural modulations on the ladder subsystem of the $Sr\_{14-x}Ca\_{x}Cu\_{24}O\_{41}$ family of compounds using ab-initio explicitly-correlated calculations. From these calculations we derived $t-J$ model as a function of the fourth crystallographic coordinate $τ$ describing the incommensurate modulations. It was found that in the highly calcium-doped system, the on-site orbital energies are strongly modulated along the ladder legs. On the contrary the two sites of the ladder rungs are iso-energetic and the holes are thus expected to be delocaliz…
We have measured the magnetization of the organic compound BIP-BNO (3,5'-bis(N-tert-butylaminoxyl)-3',5-dibromobiphenyl) up to 76 T where the magnetization is saturated. The S = 1/2 antiferromagnetic Heisenberg two-leg spin-ladder model accounts for the obtained experimental data regarding the magnetization curve, which is clarified using the quantum Monte Carlo method. The exchange constants on the rung and the side rail of the ladder are estimated to be J(rung)/kB = 65.7 K and J(leg)/kB = 14.1 K, respectively, deeply in the strong coupling region: J(rung)/J(leg) > 1.
Magnetotransport Properties of Iron-Based Ladder Compounds BaFe2S3 and BaFe2Se3 under High Pressure
Graduate School of Advanced Science and Engineering, Hiroshima University（广岛大学高级科学与工程学院）；International Institute for Sustainability with Knotted Chiral Meta Matter (WPI-SKCM2), Hiroshima University（广岛大学螺旋手性超材料可持续性国际研究所）；Department of Physics, Graduate School of Science, Tohoku University（东北大学理学院物理系）
Magnetic excitations in the spin-ladder material (C$_5$H$_{12}$N)$_2$CuBr$_4$ [BPCB] are probed by high-resolution multi-frequency electron spin resonance (ESR) spectroscopy. Our experiments provide a direct evidence for a biaxial anisotropy ($\sim 5\%$ of the dominant exchange interaction), that is in contrast to a fully isotropic spin-ladder model employed for this system previously. It is argued that this anisotropy in BPCB is caused by spin-orbit coupling, which appears to be important for describing magnetic properties of this compound. The zero-field zone-center gap in the excitation spe…
We analyze the effects of different coupling anisotropies in spin-1/2 ladder on the Electron Spin Resonance (ESR) shift. Combining a perturbative expression in the anisotropies with temperature dependent Density Matrix Renormalization Group (T-DMRG) computation of the short range correlations, we provide the full temperature and magnetic field evolution of the ESR paramagnetic shift. We show that for well chosen parameters the ESR shift can be in principle used to extract quantitatively the anisotropies and, as an example, discuss the material $\mathrm{(C_5H_{12}N)_2CuBr_4}$ (BPCB).
Experimental and theoretical studies of the unoccupied electronic structure of CaCu2O3 single crystals have been performed using polarization-dependent x-ray absorption spectroscopy and band structure calculations. The measured hole distribution shows an unusual large number of holes in orbitals parallel to the interlayer direction which is in agreement with the theoretical analysis. CaCu2O3 deviates significantly from the standard pd-sigma cuprate picture. The corresponding strong interlayer exchange is responsible for the missing spin gap generic for other two-leg ladder cuprates.
We report the direct observation by inelastic neutron scattering experiments of a spin triplet of magnetic excitations in the response associated with the ladders in the composite cuprate Sr14Cu24O41. This appears as a peak at q_{Q1D}=πand energy Δ_1=32.5 meV, and we conjecture that all the triplets making up this conspicuous peak have the same phase and therefore interpret it as the signature of the occurrence of quantum coherence along the ladder direction between entangled spin pairs. From the comparison with previous neutron and x-ray data, we conclude that the temperature evolution of thi…
The title compounds have dominant ferromagnetic (FM) exchange interactions within one-dimensional (1D) half-twist ladders of s =1/2 Cu2^{+} ions and antiferromagnetic(AFM) interactions between ladders, leading to ordered 3D phases at temperatures below 20K. Here we show that a microscopic 1D model of the paramagnetic (PM) phase combined with a phenomenological model based on sublattice magnetization describes the observed temperature and field dependent magnetism. The model identifies AFM, spin-flop (SF) and PM phases whose boundaries have sharp features in the experimental magnetization M(T,H…
Motivated by increasing experimental evidence of exotic magnetism in low-dimensional iron-based materials, we present a comprehensive theoretical analysis of magnetic states of the multiorbital Hubbard ladder in the orbital-selective Mott phase (OSMP). The model we used is relevant for iron-based compounds of the AFe$_2$X$_3$ family (where A${}={}$Cs, Rb, Ba, K are alkali metals and X${}={}$S, Se are chalcogenides). To reduce computational effort, and obtain almost exact numerical results in the ladder geometry, we utilize a low-energy description of the Hubbard model in the OSMP - the general…
The $S=1/2$ spin ladder compound (C$_5$H$_{12}$N)$_2$CuBr$_4$ (BPCB) is studied by means of high-resolution inelastic neutron scattering. In agreement with previous studies we find a band of triplet excitations with a spin gap of $\sim0.8$~meV and a bandwidth of $\sim0.6$~meV. In addition, we observe a distinct splitting of the triplet band of $50(1)$~$μ$eV or $40(2)$~$μ$eV at the band minimum or maximum, respectively. By comparison to a strong coupling expansion calculation of the triplet dispersion for a spin ladder with anisotropic exchange, weakly anisotropic leg interactions are identifie…
The thermodynamic behavior of the spin $S=1/2$ antiferromagnetic two-leg ladder compound $(C_{5}H_{12}N)_{2} CuBr_{4}$ in a uniform magnetic field is studied using numerical and analytical approaches. The entropy $S(H,T)$ and specific heat $C(H,T)$ are calculated. The specific heat shows various behaviors in different regions of the magnetic field. The field-dependence of the specific heat is almost symmetric about the average of quantum critical fields in complete agreement with experimental results. In addition, it is found that during an adiabatic demagnetization process, temperature drops …
Quasi-one-dimensional iron chalcogenides possess various magnetic states depending on the lattice distortion, electronic correlations, and presence of defects. We present neutron diffraction and inelastic neutron scattering experiments on the spin ladder compound BaFe$_{2-δ}$S$_{1.5}$Se$_{1.5}$ with $\sim$6% iron vacancies. The data reveal that long-range magnetic order is absent, while the characteristic magnetic excitations that correspond to both the stripe- and block-type antiferromagnetic correlations are observed. First-principles calculations support the existence of both stripe and blo…
Electrical resistivity measurements have been performed on the iron-based ladder compounds Ba$_{1-x}$Cs$_x$Fe$_2$Se$_3$ ($x$ = 0, 0.25, 0.65, and 1) under high pressure. A cubic anvil press was used up to 8.0 GPa, whereas further higher pressure was applied using a diamond anvil cell up to 30.0 GPa. Metallic behavior of the electrical conductivity was confirmed in the $x$ = 0.25 and 0.65 samples for pressures greater than 11.3 and 14.4 GPa, respectively, with the low-temperature $\log T$ upturn being consistent with weak localization of 2D electrons due to random potential. At pressures higher…
The quasi-one-dimensional spin ladder compounds, BaFe$_2$S$_3$ and BaFe$_2$Se$_3$, are investigated by infrared spectroscopy and density functional theory (DFT) calculations. We observe strong anisotropic electronic properties and an optical gap in the leg direction that is gradually filled above the antiferromagnetic (afm) ordering temperature, turning the systems into a metallic phase. Combining the optical data with the DFT calculations we associate the optical gap feature with the $p$-$d$ transition that appears only in the afm ordered state. Hence, the insulating ground state along the le…
We study the magnetic, structural, and electronic properties of the recently discovered iron- based superconductor BaFe2S3 based on density functional theory with the generalized gradient approximation. The calculations show that the magnetic alignment in which the spins are coupled ferromagnetically along the rung and antiferromagnetically along the leg is the most stable in the possible magnetic structure within an Fe-ladder and is further stabilized with the periodicity char- acterized by the wave vector Q=(pi,pi,0), leading to the experimentally observed magnetic ground state. The magnetic…
We present experiments on the magnetic field-dependent thermal transport in the spin-1/2 ladder system (C$_5$H$_{12}$N)$_2$CuBr$_4$. The thermal conductivity $κ(B)$ is only weakly affected by the field-induced transitions between the gapless Luttinger-liquid state realized for $B_{c1}< B < B_{c2}$ and the gapped states, suggesting the absence of a direct contribution of the spin excitations to the heat transport. We observe, however, that the thermal conductivity is strongly suppressed by the magnetic field deeply within the Luttinger-liquid state. These surprising observations are discussed i…
Electronic and magnetic structures of iron selenide compounds Ce2O2FeSe2 (2212\ast) and BaFe2Se3(123\ast) are studied by the first-principles calculations. We find that while all these compounds are composed of one-dimensional (1D) Fe chain (or ladder) structures, their electronic structures are not close to be quasi-1D. The magnetic exchange couplings between two nearest-neighbor (NN) chains in 2212\ast and between two NN two-leg-ladders in 123\ast are both antiferromagnetic (AFM), which is consistent with the presence of significant third NN AFM coupling, a common feature shared in other iro…
Motivated by the recent report of superconductivity in Fe-based ladder materials, we study the pairing state of a multi-orbital t-J model defined on two-leg ladders using the standard mean-field theory. We find that the superconducting order parameters change sign between the $d_{xz}$ and $d_{yz}$ orbitals in most of the phase diagram. By analogy with the two-dimensional Fe planes, we conclude that the leading pairing channel of this state belongs to the $B_{1g}$ symmetry class, which is distinct from the common $s_{\pm}$ gap with the $A_{1g}$ symmetry. By smoothly interpolating from planes in…
The field induced quantum phase transitions in the disorder-free and disordered samples of the spin ladder material (CH_3)_2CHNH_3Cu(Cl_{1-x}Br_x)_3 are studied using magnetic calorimetry and magnetic neutron diffraction on single crystal samples. Drastically different critical indexes and correlation lengths in the high field phase are found for two different orientations of the applied field. It is argued that for a field applied along the crystallographic c axis, as in previous studies [1], the transition is best described as an Ising transition in random field and anisotropy, rather than a…
We have used a combination of neutron resonant spin-echo and triple-axis spectroscopies to determine the energy and linewidth of the magnon resonance in IPA-Cu(Cl$_{0.95}$Br$_{0.05}$)$_3$, a model spin-1/2 ladder antiferromagnet where Br substitution induces bond randomness. We find that the bond defects induce a blueshift, $δΔ$, and broadening, $δΓ$, of the magnon gap excitation compared to the pure compound. At temperatures exceeding the energy scale of the inter-ladder exchange interactions, $δΔ$ and $δΓ$ are temperature independent within the experimental error, in agreement with Matthiess…
We have used a combination of neutron resonant spin-echo and triple-axis spectroscopies to determine the energy, fine structure, and linewidth of the magnon resonance in the model spin-1/2 ladder antiferromagnet IPA-CuCl_3 at temperatures T << Delta_0 /k_B, where Delta_0 is the spin gap at T=0. In this low-temperature regime we find that the results deviate substantially from the predictions of the non-linear sigma model proposed as a description of magnon excitations in one-dimensional quantum magnets and attribute these deviations to real-space and spin-space anisotropies in the spin Hamilto…
We report the observation of a frequency ($ω$) and temperature (T) -dependent loss peak in $χ''$ and accompanying dispersion in $χ'$ from microwave (2-18GHz) measurements of the complex susceptibility $\tildeχ(ω, T)=χ'+iχ''$ of $Sr_{14-x}Ca_{x}Cu_{24}O_{41}$. We associate this phenomenon with a rapid decrease of spin disorder and corresponding spin relaxation rate, representing a ``spin freezing transition'' accompanying charge ordering which occurs at temperatures $\sim 250K$. Our results enable direct quantitative measurements of the spin relaxation rate, and yield information on spin dynami…
The crystal structure and the magnetism of BaMn$_2$O$_3$ have been studied by thermodynamic and by diffraction techniques using large single crystals and powders. BaMn$_2$O$_3$ is a realization of a $S = 5/2$ spin ladder as the magnetic interaction is dominant along 180$^\circ$ Mn-O-Mn bonds forming the legs and the rungs of a ladder. The temperature dependence of the magnetic susceptibility exhibits well-defined maxima for all directions proving the low-dimensional magnetic character in BaMn$_2$O$_3$. The susceptibility and powder neutron diffraction data, however, show that BaMn$_2$O$_3$ exh…
LaCuO_2.5 is a system of coupled, two-chain, cuprate ladders which may be doped systematically by Sr substitution. Motivated by the recent synthesis of single crystals, we investigate theoretically the possibility of superconductivity in this compound. We use a model of spin fluctuation-mediated superconductivity, where the pairing potential is strongly peaked at πin the ladder direction. We solve the coupled gap equations on the bonding and antibonding ladder bands to find superconducting solutions across the range of doping, and discuss their relevance to the real material.
The incommensurate composite systems M14Cu24O41 (M=Ca,Sr,La) are based on two fundamental structural units: CuO2 chains and Cu2O3 ladders. We present electronic structure calculations within density functional theory in order to address the interrelations between chains and ladders. The calculations account for the details of the crystal structure by means of a unit cell comprising 10 chain and 7 ladder units. It turns out that chains and ladders can be treated independently, which allows us to introduce a model system based on a reduced unit cell. For the CuO2 chains, we find two characterist…
A comprehensive theoretical and experimental study is presented of the magnetic susceptibility versus temperature χ(T) of spin S = 1/2 two- and three-leg Heisenberg ladders and ladder oxide compounds. Extensive quantum Monte Carlo simulations of χ(T) were carried out for both isolated and coupled two-leg ladders with spatially anisotropic intraladder exchange. Accurate fits to these and related literature QMC data were obtained. We have also calculated the one- and two-magnon dispersion relations and the dynamical spin structure factor for anisotropic isolated 2 x 12 ladders. The exchange cons…
We used transport and Raman scattering measurements to identify the insulating state of self-doped spin 1/2 two-leg ladders of Sr_{14}Cu_{24}O_{41} as a weakly pinned, sliding density wave with non-linear conductivity and a giant dielectric response that persists to remarkably high temperatures.
We report the measurements of the pseudodielectric function, far-infrared reflectivity and Raman scattering spectra in Sr_{14}Cu_{24}O_{41} single crystal. We study the lattice and the spin dynamics of the Cu$_2$O$_3$ spin ladders and CuO$_2$ chains of this compound. The ellipsometric and the optical reflectivity measurements yield the gap values of 1.4 eV, 1.86 eV, 2.34 eV (2.5 eV) for the ladders (chains) along the {\bf c}-axis and 2.4 eV along the {\bf a}-axis. The electronic structure of the Cu$_2$O$_3$ ladders is analyzed using tight-binding approach for the correlated electron systems. T…
Here we show that the 2.80(8) μB/Fe block antiferromagnetic order of BaFe2Se3 transforms into stripe antiferromagnetic order in KFe2Se3 with a decrease in moment to 2.1(1) μB/Fe. This reduction is larger than expected from the change in electron count from Ba$^{2+}$ to K$^{+}$, and occurs with the loss of the displacements of Fe atoms from ideal positions in the ladders, as found by neutron pair distribution function analysis. Intermediate compositions remain insulating, and magnetic susceptibility measurements show a suppression of magnetic order and probable formation of a spin-glass. Togeth…
We present the Raman-scattering spectra of CaV2O5 and MgV2O5. The magnetic contribution in the Raman spectra of CaV2O5 is found in the form of a strong asymmetric line, centered at 2Delta, with a tail on the high-energy side. Our analysis of its spectral shape shows that the magnetic ordering in CaV2O5 can be described using a S=1/2 two-leg ladder Heisenberg antiferromagnetic model with Jparallel/Jperp = 0.1, and a small interladder exchange. The spin gap and exchange constant are estimated to be Delta = 400 cm-1 (570 K) and Jperp = 640 K. No magnon bound states are found. In contrast to CaV2O…
Magnetism in the insulating BaFe$_2$Se$_3$ was examined through susceptibility, specific heat, resistivity and neutron diffraction measurements. After formation of a short-range magnetic correlation, a long-range ordering was observed below $T_{\rm N}\sim 255$ K. The transition is obscured by bulk properties. Magnetic moments ($\parallel a$) are arranged to form a Fe$_4$ ferromagnetic unit, and each Fe$_4$ stacks antiferromagnetically. This block magnetism is of the third type among magnetic structures of ferrous materials. The magnetic ordering drives unusually large distortion via magnetoela…
The distribution of holes in Sr$_{14-x}$Ca$_x$Cu$_{24}$O$_{41}$ (SCCO) is revisited with semi-emperical reanalysis of the x-ray absorption (XAS) data and exact-diagonalized cluster calculations. A new interpretation of the XAS data leads to much larger ladder hole densities than previously suggested. These new hole densities lead to a simple interpretation of the hole crystal (HC) recently reported with 1/3 and 1/5 wave vectors along the ladder. Our interpretation is consistent with paired holes in the rung of the ladders. Exact diagonalization results for a minimal model of the doped ladders …
Magnetostriction and thermal expansion of the spin-ladder compound piperidinium copper bromide (C$_5$H$_{12}$N)$_2$CuBr$_4$ are analyzed in detail. We find perfect agreement between experiments and the theory of a two-leg spin ladder Hamiltonian for more than a decade in temperature and in a wide range of magnetic fields. Relating the magnetostriction along different crystallographic directions to two static spin-spin correlation functions, which we compute with Quantum Monte Carlo, allows us to reconstruct the magnetoelastic couplings of (C$_5$H$_{12}$N)$_2$CuBr$_4$. We especially focus on th…
We have grown single crystals of the iron-based ladder material BaFe_2S_3, which is superconductive under high pressure, adopting different conditions. By comparing the behaviors of these samples, it is found that the in situ annealing process can affect the crystal structure and the electrical transport, enhance the antiferromagnetic transition temperature, and reduce the extrinsic ferromagnetic component of the system. An in-depth analysis indicates that the crystal quality is improved by the in situ annealing in terms of reducing both the Fe deficiency and the Fe impurity in the samples. Th…
The low-temperature (LT) superstructure of $α'$-NaV$_2$O$_5$ was determined by synchrotron radiation x-ray diffraction. Below the phase transition temperature associated with atomic displacement and charge ordering at 34K, we observed the Bragg peak splittings, which evidence that the LT structure is monoclinic. It was determined that the LT structure is $(a-b)\times 2b \times 4c$ with the space group $A112$ where $a, b$ and $c$ represent the high temperature orthorhombic unit cell. The valence estimation of V ions according to the bond valence sum method shows that the V sites are clearly sep…
Motivated by recent experimental progress on iron-based ladder compounds, we study the doped two-orbital Hubbard model for the two-leg ladder BaFe$_2$S$_3$. The model is constructed by using {\it ab initio} hopping parameters and the ground state properties are investigated using the density matrix renormalization group method. We show that the $(π,0)$ magnetic ordering at half-filling, with ferromagnetic rungs and antiferromagnetic legs, becomes incommensurate upon hole doping. Moreover, depending on the strength of the Hubbard $U$ coupling, other magnetic patterns, such as $(0,π)$, are also …
We report on a sequence of field-induced transitions in the zigzag ladder compound BaDy2O4 studied with powder neutron diffraction and magnetisation measurements. In agreement with the previously published results, the low temperature zero-field structure is characterised by two half-integer propagation vectors, k1=[1/2 0 1/2] and k2= 1/2 1/2 1/2]. However, on application of an external magnetic field, the Bragg peaks corresponding to the zero-field structure lose their intensity rather rapidly and disappear completely in a field of 2.5 kOe. In the intermediate fields, 2.5 to 22.5 kOe, new pea…
The unoccupied electronic structure for the Sr_14Cu_24O_41 family of two-leg ladder compounds was investigated for different partial substitutions of Sr^2+ by Ca^2+, leaving the nominal hole count constant, and by Y^3+ or La^3+, reducing the nominal hole count from its full value of 6 per formula unit. Using polarization-dependent x-ray absorption spectroscopy on single crystals, hole states on both the chain and ladder sites could be studied. While for intermediate hole counts all holes reside on O sites of the chains, a partial hole occupation on the ladder sites in orbitals oriented along t…
We report an inelastic neutron scattering study of the spin waves of the one-dimensional antiferromagnetic spin ladder compound RbFe$_2$Se$_3$. The results reveal that the products, $SJ$'s, of the spin $S$ and the magnetic exchange interactions $J$'s along the antiferromagnetic (leg) direction and the ferromagnetic (rung) direction are comparable with those for the stripe ordered phase of the parent compounds of the iron-based superconductors. The universality of the $SJ$'s implies nearly universal spin wave dynamics and the irrelevance of the fermiology for the existence of the stripe antifer…
New varieties of quasi-one-dimensional halogen (X)-bridged transition-metal (M) complexes, (C_8_H_6_N_4_)[Pt(C_2_H_8_N_2_)X]_2_X(ClO_4_)_3_\cdotH_2_O (X=Br,Cl) and (C_10_H_8_N_2_)[Pt(C_4_H_13_N_3_)Br]_2_Br_4_\cdot2H_2_O, comprising two-leg ladders of mixed-valent platinum ions, are described in terms of a multiband extended Peierls-Hubbard Hamiltonian. The polarized optical conductivity spectra are theoretically reproduced and the ground-state valence distributions are reasonably determined. The latter variety, whose interchain valence arrangement is out of phase, is reminiscent of conventiona…
The pressure effects on the antiferromagentic orders in iron-based ladder compounds CsFe$_2$Se$_3$ and BaFe$_2$S$_3$ have been studied using neutron diffraction. With identical crystal structure and similar magnetic structures, the two compounds exhibit highly contrasting magnetic behaviors under moderate external pressures. In CsFe$_2$Se$_3$ the ladders are brought much closer to each other by pressure, but the stripe-type magnetic order shows no observable change. In contrast, the stripe order in BaFe$_2$S$_3$, undergoes a quantum phase transition where an abrupt increase of N$\acute{e}$el t…
We present magnetic suscceptibility and heat capacity data on a new S=1/2 two-leg spin ladder compound BiCu2PO6. From our susceptibility analysis, we find that the leg coupling J1/k_B is ~ 80 K and the ratio of the rung to leg coupling J2/J1 ~ 0.9. We present the magnetic contribution to the heat capacity of a two-leg ladder. The spin-gap Delta/k_B =3 4 K obtained from the heat capacity agrees very well with that obtained from the magnetic susceptibility. Significant inter-ladder coupling is suggested from the susceptibility analysis. The hopping integrals determined using Nth order muffin tin…
The magnetic and electronic phase diagram of a model for the quasi-one-dimensional alkali metal iron selenide compound Na$_2$FeSe$_2$ is presented. The novelty of this material is that the valence of iron is Fe$^{2+}$ contrary to most other iron-chain compounds with valence Fe$^{3+}$. Using first-principles techniques, we developed a three-orbital tight-binding model that reproduces the {\it ab initio} band structure near the Fermi level. Including Hubbard and Hund couplings and studying the model via the density matrix renormalization group and Lanczos methods, we constructed the ground state…
The present study shows that the electronic structure of the $β$-$AV\_6O\_{15}$ family of compounds ($A = Sr, Ca, Na ...$) is based on weakly interacting two-leg ladders, in contrast with the zig-zag chain model one could expect from their crystal structure. Spin dimer analysis, based on extended Hückel tight-binding calculations, was performed to determine the structure of the dominant transfer and magnetic interactions in the room temperature $β$-$SrV\_6O\_{15}$ phase. Two different two-legs ladders, associated with different charge/spin orders are proposed to describe these one-dimensional …
The magnetic properties of polycrystalline samples of Ba3Cu3In4O12 (In-334) and Ba3Cu3Sc4O12 (Sc-334) are reported. Both 334 phases have a structure derived from perovskite, with CuO4 squares interconnected to form half-twist ladders along the c-axis. The Cu-O-Cu angles, ~ 90o, and the positive Weiss temperatures indicate the presence of significant ferromagnetic (FM) interactions along the Cu ladders. At low temperatures, T < 20 K, sharp transitions in the magnetic susceptibility and heat capacity measurements indicate three-dimensional (3D) antiferromagnetic (AFM) ordering at TN. TN is suppr…
We study the field-induced quantum phase transitions (QPT) and the relevant magnetic properties of a spin-1/2 two-leg integrable spin ladder (ISL), of which the system parameters in bridging to the real compounds are determined by setting the extra interactions in the Hamiltonian of the ISL relative to the Heisenberg spin ladder to vanish in the expectation in the ground state (GS). Such an ISL analytically has the correct leading terms of both the critical fields of the two QPT's as in the real strongly-coupled compounds: gμ_BH_{c1}=J_{\perp}-J_{\parallel} and gμ_BH_{c2}=J_{\perp}+2J_{\parall…
We study the electronic structure of the ladder compounds (SrCa)CuO 14-24-41 and SrCuO 123. LDA calculations for both give similar Cu 3d-bands near the Fermi energy. The hopping parameters estimated by fitting LDA energy bands show a strong anisotropy between the t_perp t_par intra-ladder hopping and small inter-ladder hopping. A downfolding method shows that this anisotropy arises from the ladder structure.The conductivity perpendicular to the ladders is computed assuming incoherent tunneling giving a value close to experiment.
We present magnetoresistivity measurements in high-quality single crystals of the Nowotny chimney ladder compound Ru$_2$Sn$_3$. We find a linear and nonsaturating magnetoresistance up to 20 T. The magnetoresistance changes with the magnetic field orientation at small magnetic fields, from a positive to a negative curvature. Above 5 T, the magnetoresistance shows no sign of saturation up to 20 T for any measured angle. The shape of the anisotropy in the magnetoresistance remains when increasing temperature and Kohler's rule is obeyed. We associate the linear and nonsaturating magnetoresistance …
According to the celebrated Onsagar-Lifshitz paradigm, the observation of Shubnikov de-Haas and de-Haas van Alphen (SdHvA) oscillations is an indication of the presence of `closed' orbit Fermi surface in the bulk. We present a real-space based calculation of SdHvA oscillations in generalized quasi-one-dimensional lattices by relaxing the quasi-classical approximations embedded in this decades old Onsagar-Lifshitz paradigm. We find that sizable quantum oscillation can arise from `open' Fermi surfaces as long as cyclotron orbits can form in real-space with finite, but not necessarily equal, elec…
In this editorial, we first give a brief survey of the field of iron-selenide superconductivity, both in the case of bulk FeSe characterized by the co-existence of superconductivity and nematic order, and in the case of electron-doped FeSe characterized by high-temperature superconductivity. We next review the 8 contributions to the Frontiers in Physics research topic "High-Tc Superconductivity in Electron-Doped Iron Selenide and Related Compounds".
Specific heat measurements down to 0.5 K have been performed on a single crystal sample of a spin-ladder like compound Cu$_{2}$(C$_{5}$H$_{12}$N$_{2}$)$_{2}$Cl$_{4}$ under magnetic fields up to 12 T. The temperature dependence of the observed data in a magnetic field below 6 T is well reproduced by numerical results calculated for the S=1/2 two-leg ladder with $J_{\rm{rung}}$/$J_{\rm{leg}}$=5. In the gapless region above 7 T ($H_{\rm{c1}}$), the agreement between experiment and calculation is good above about 2 K and a sharp and a round peak were observed below 2 K in a magnetic field around 1…
Appearance of the second coherent peak in the dynamical structure factor of an asymmetric spin ladder is suggested. The general arguments are confirmed by the first order (with respect to the asymmetry) calculation for a spin ladder with singlet-rung ground state. Basing on this result a new interpretation is proposed for the inelastic neutron scattering data in the spin gap compound CuHpCl.
