arXiv subjects

Qimiao Si

Publications and source records attributed to Qimiao Si.

At least 163 records · Page 9Linked to original sources

arXiv2015

Energy dependence of the spin excitation anisotropy in uniaxial-strained BaFe1.9Ni0.1As2

We use inelastic neutron scattering to study the temperature and energy dependence of the spin excitation anisotropy in uniaxial-strained electron-doped iron pnictide BaFe$_{1.9}$Ni$_{0.1}$As$_2$ near optimal superconductivity ($T_c=20$ K). Our work has been motivated by the observation of in-plane resistivity anisotropy in the paramagnetic tetragonal phase of electron-underdoped iron pnictides under uniaxial pressure, which has been attributed to a spin-driven Ising-nematic state or orbital ordering. Here we show that the spin excitation anisotropy, a signature of the spin-driven Ising-nematic phase, exists for energies below $\sim$60 meV in uniaxial-strained BaFe$_{1.9}$Ni$_{0.1}$As$_2$. Since this energy scale is considerably larger than the energy splitting of the $d_{xz}$ and $d_{yz}$ bands of uniaxial-strained Ba(Fe$_{1-x}$Co$_x$)$_2$As$_2$ near optimal superconductivity, spin Ising-nematic correlations is likely the driving force for the resistivity anisotropy and associated electronic nematic correlations.

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arXiv2015

Glide reflection symmetry, Brillouin zone folding and superconducting pairing for the $P4/nmm$ space group

Motivated by the studies of the superconducting pairing states in the iron-based superconductors, we analyze the effects of Brillouin zone folding procedure from a space group symmetry perspective for a general class of materials with the $P4/nmm$ space group. The Brillouin zone folding amounts to working with an effective one-Fe unit cell, instead of the crystallographic two-Fe unit cell. We show that the folding procedure can be justified by the validity of a glide reflection symmetry throughout the crystallographic Brillouin zone and by the existence of a minimal double degeneracy along the edges of the latter. We also demonstrate how the folding procedure fails when a local spin-orbit coupling is included although the latter does not break any of the space group symmetries of the bare Hamiltonian. In light of these general symmetry considerations, we further discuss the implications of the glide reflection symmetry for the superconducting pairing in an effective multi-orbital $t-J_{1}-J_{2}$ model. We find that the $P4/nmm$ space group symmetry allows only pairing states with even parity under the glide reflection and zero total momentum.

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arXiv2015

Quantum criticality in AFe2As2 with A = K, Rb, and Cs suppresses superconductivity

Superconductors close to quantum phase transitions often exhibit a simultaneous increase of electronic correlations and superconducting transition temperatures. Typical examples are given by the recently discovered iron-based superconductors. We investigated the band-specific quasiparticle masses of AFe2As2 single crystals with A = K, Rb, and Cs and determined their pressure dependence. The evolution of electronic correlations could be tracked as a function of volume and hole doping. The results indicate that with increasing alkali-metal ion radius a quantum critical point is approached. The critical fluctuations responsible for the enhancement of the quasiparticle masses appear to suppress the superconductivity.

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arXiv2015

Global Phase Diagram and Momentum Distribution of Single-Particle Excitations in Kondo insulators

Kondo insulators are emerging as a simplified setting to study both magnetic and metal-to-insulator quantum phase transitions. Here, we study a half-filled Kondo lattice model defined on a magnetically frustrated Shastry-Sutherland geometry. We determine a "global" phase diagram that features a variety of zero-temperature phases; these include Kondo-destroyed antiferromagnetic and paramagnetic metallic phases in addition to the Kondo-insulator phase. Our result provides the theoretical basis for understanding how applying pressure to a Kondo insulator can close its hybridization gap, liberate the local-moment spins from the conduction electrons, and lead to a magnetically correlated metal. We also study the momentum distribution of the single-particle excitations in the Kondo insulating state, and illustrate how Fermi-surface-like features emerge as a precursor to the actual Fermi surfaces of the Kondo-destroyed metals. We discuss the implications of our results for Kondo insulators including SmB$_6$.

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arXiv2015

Antiferroquadrupolar and Ising-Nematic Orders of a Frustrated Bilinear-Biquadratic Heisenberg Model and Implications for the Magnetism of FeSe

Motivated by the properties of the iron chalcogenides, we study the phase diagram of a generalized Heisenberg model with frustrated bilinear-biquadratic interactions on a square lattice. We identify zero-temperature phases with antiferroquadrupolar and Ising-nematic orders. The effects of quantum fluctuations and interlayer couplings are analyzed. We propose the Ising-nematic order as underlying the structural phase transition observed in the normal state of FeSe, and discuss the role of the Goldstone modes of the antiferroquadrupolar order for the dipolar magnetic fluctuations in this system. Our results provide a considerably broadened perspective on the overall magnetic phase diagram of the iron chalcogenides and pnictides, and are amenable to tests by new experiments.

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arXiv2015

Observation of universal strong orbital-dependent correlation effects in iron chalcogenides

Establishing the appropriate theoretical framework for unconventional superconductivity in the iron-based materials requires correct understanding of both the electron correlation strength and the role of Fermi surfaces. This fundamental issue becomes especially relevant with the discovery of the iron chalcogenide (FeCh) superconductors, the only iron-based family in proximity to an insulating phase. Here, we use angle-resolved photoemission spectroscopy (ARPES) to measure three representative FeCh superconductors, FeTe0.56Se0.44, K0.76Fe1.72Se2, and monolayer FeSe film grown on SrTiO3. We show that, these FeChs are all in a strongly correlated regime at low temperatures, with an orbital-selective strong renormalization in the dxy bands despite having drastically different Fermi-surface topologies. Furthermore, raising temperature brings all three compounds from a metallic superconducting state to a phase where the dxy orbital loses all spectral weight while other orbitals remain itinerant. These observations establish that FeChs display universal orbital-selective strong correlation behaviors that are insensitive to the Fermi surface topology, and are close to an orbital-selective Mott phase (OSMP), hence placing strong constraints for theoretical understanding of iron-based superconductors.

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arXiv2015

Electronic nematic correlations in the stress free tetragonal state of BaFe$_{2-x}$Ni$_{x}$As$_{2}$

We use transport and neutron scattering to study electronic, structural, and magnetic properties of the electron-doped BaFe$_{2-x}$Ni$_x$As$_2$ iron pnictides in the external stress free detwinned state. Using a specially designed in-situ mechanical detwinning device, we demonstrate that the in-plane resistivity anisotropy observed in the uniaxial strained tetragonal state of BaFe$_{2-x}$Ni$_x$As$_2$ below a temperature $T^\ast$, previously identified as a signature of the electronic nematic phase, is also present in the stress free tetragonal phase below $T^{\ast\ast}$ ($<T^\ast$). By carrying out neutron scattering measurements on BaFe$_2$As$_2$ and BaFe$_{1.97}$Ni$_{0.03}$As$_2$, we argue that the resistivity anisotropy in the stress free tetragonal state of iron pnictides arises from the magnetoelastic coupling associated with antiferromagnetic order. These results thus indicate that the local lattice distortion and nematic spin correlations are responsible for the resistivity anisotropy in the tetragonal state of iron pnictides.

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arXiv2015

Orbital selectivity and emergent superconducting state from quasi-degenerate $s-$ and $d-$wave pairing channels in iron-based superconductors

A major puzzle about the nature of the iron-based superconductivity appears in the case of the alkaline iron selenides. Compared to the iron pnictides, these systems have only electron Fermi pockets (i.e. no hole Fermi pockets) but comparable superconducting transition temperatures. The challenge lies in reconciling the two basic experimental features of their superconducting state: a node-less gap and the existence of a resonance in the spin excitation spectrum. We propose a mechanism based on reconstructing two quasi-degenerate pairing states, one in an $s$-wave $A_{1g}$ channel that is fully gapped, and the other in a $d$-wave $B_{1g}$ channel whose pairing function changes sign across the electron Fermi pockets at the Brillouin-zone boundary. The resulting intermediate pairing state, which we call an orbital-selective $s \times τ_3$ state, incorporates both of the above two properties. When the leading spin-singlet pairing is in the $d_{xz}, d_{yz}$ orbital subspace, this state retains the $s$-wave form factor but has a $B_{1g}$ symmetry due to an internal $τ_3$ structure in the orbital space. Within a five-orbital $t-J_{1}-J_{2}$ model with orbital-selective exchange couplings, we show that the proposed pairing state is energetically competitive over a finite range of control parameters. We calculate the dynamical spin susceptibility in the orbital-selective $s \times τ_3$ superconducting state and show that a spin resonance arises and has the characteristics of observed by inelastic neutron experiments in the alkaline iron selenides. More generally, the formation of the orbital-selective $s \times τ_3$ state represents a novel means of relieving the quasi-degeneracy between $s-$ and $d-$wave pairing states, which is a hitherto unsuspected alternative to the conventional route of linearly superposing the two into a time-reversal symmetry breaking $s+id$ state.

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arXiv2015

Cluster Extended Dynamical Mean Field Approach and Unconventional Superconductivity

The extended dynamical mean field theory has played an important role in the study of quantum phase transitions in heavy fermion systems. In order to incorporate the physics of unconventional superconductivity, we develop a cluster version of the extended dynamical mean field theory. In this approach, we show how magnetic order and superconductivity develop as a result of inter-site spin exchange interactions, and analyze in some detail the form of correlation functions. We also discuss the methods that can be used to solve the dynamical equations associated with this approach. Finally, we consider different settings in which our approach can be applied, including the periodic Anderson model for heavy fermion systems.

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arXiv2015

Experimental Observation of Incoherent-Coherent Crossover and Orbital Dependent Band Renormalization in Iron Chalcogenide Superconductors

The level of electronic correlation has been one of the key questions in understanding the nature of superconductivity. Among the iron-based superconductors, the iron chalcogenide family exhibits the strongest electron correlations. To gauge the correlation strength, we performed systematic angle-resolved photoemission spectroscopy study on the iron chalcogenide series Fe$_{1+y}$Se$_x$Te$_{1-x}$ (0$<$x$<$0.59), a model system with the simplest structure. Our measurement reveals an incoherent to coherent crossover in the electronic structure as the selenium ratio increases and the system evolves from the weakly localized to more itinerant state. Furthermore, we found that the effective mass of bands dominated by the d$_{xy}$ orbital character significantly decreases with increasing selenium ratio, as compared to the d$_{xz}$/d$_{yz}$ orbital-dominated bands. The orbital dependent change in the correlation level agrees with theoretical calculations on the band structure renormalization, and may help to understand the onset of superconductivity in Fe$_{1+y}$Se$_x$Te$_{1-x}$.

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arXiv2015

Neutron spin resonance as a probe of superconducting gap anisotropy in partially detwinned electron underdoped NaFe$_{0.985}$Co$_{0.015}$As

We use inelastic neutron scattering (INS) to study the spin excitations in partially detwinned NaFe$_{0.985}$Co$_{0.015}$As which has coexisting static antiferromagnetic (AF) order and superconductivity ($T_c=15$ K, $T_N=30$ K). In previous INS work on a twinned sample, spin excitations form a dispersive sharp resonance near $E_{r1}=3.25$ meV and a broad dispersionless mode at $E_{r1}=6$ meV at the AF ordering wave vector ${\bf Q}_{\rm AF}={\bf Q}_1=(1,0)$ and its twinned domain ${\bf Q}_2=(0,1)$. For partially detwinned NaFe$_{0.985}$Co$_{0.015}$As with the static AF order mostly occurring at ${\bf Q}_{\rm AF}=(1,0)$, we still find a double resonance at both wave vectors with similar intensity. Since ${\bf Q}_1=(1,0)$ characterizes the explicit breaking of the spin rotational symmetry associated with the AF order, these results indicate that the double resonance cannot be due to the static and fluctuating AF orders, but originate from the superconducting gap anisotropy.

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arXiv2014

Finite temperature spin dynamics in a perturbed quantum critical Ising chain with an $E_8$ symmetry

A spectrum exhibiting $E_8$ symmetry is expected to arise when a small longitudinal field is introduced in the transverse-field Ising chain at its quantum critical point. Evidence for this spectrum has recently come from neutron scattering measurements in cobalt niobate, a quasi one-dimensional Ising ferromagnet. Unlike its zero-temperature counterpart, the finite-temperature dynamics of the model has not yet been determined. We study the dynamical spin structure factor of the model at low frequencies and nonzero temperatures, using the form factor method. Its frequency dependence is singular, but differs from the diffusion form. The temperature dependence of the nuclear magnetic resonance (NMR) relaxation rate has an activated form, whose prefactor we also determine. We propose NMR experiments as a means to further test the applicability of the $E_8$ description for CoNb$_2$O$_6$.

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arXiv2014

Quantum Phases of the Shastry-Sutherland Kondo Lattice: Implications for the Global Phase Diagram of Heavy Fermion Metals

Considerable recent theoretical and experimental efforts have been devoted to the study of quantum criticality and novel phases of antiferromagnetic heavy-fermion metals. In particular, quantum phase transitions have been discovered in the compound Yb$_2$Pt$_2$Pb. These developments have motivated us to study the competition between the RKKY and Kondo interactions on the Shastry-Sutherland lattice. We determine the zero-temperature phase diagram as a function of magnetic frustration and Kondo coupling within a slave-fermion approach. Pertinent phases include the Shastry-Sutherland valence bond solid and heavy Fermi liquid. In the presence of antiferromagnetic order, our zero-temperature phase diagram is remarkably similar to the global phase diagram proposed earlier based on general grounds. We discuss the implications of our results for the experiments on Yb$_2$Pt$_2$Pb and other geometrically frustrated heavy fermion compounds.

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arXiv2014

Anisotropic neutron spin resonance in underdoped superconducting NaFe1-xCoxAs

We use polarized inelastic neutron scattering (INS) to study spin excitations in superconducting NaFe0.985Co0.015As (C15) with static antiferromagnetic (AF) order along the a-axis of the orthorhombic structure and NaFe0.935Co0.045As (C45) without AF order. In previous unpolarized INS work, spin excitations in C15 were found to have a dispersive sharp resonance near Er1=3.25 meV and a broad dispersionless mode at Er2=6 meV. Our neutron polarization analysis reveals that the dispersive resonance in C15 is highly anisotropic and polarized along the a- and c-axis, while the dispersionless mode is isotropic similar to that of C45. Since the a-axis polarized spin excitations of the anisotropic resonance appear below Tc, our data suggests that the itinerant electrons contributing to the magnetism are also coupled to the superconductivity.

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arXiv2014

Heavy Fermion Quantum Criticality and Destruction of the Kondo Effect in a Nickel Oxypnictide

A quantum critical point arises at a continuous transformation between distinct phases of matter at zero temperature. Studies in antiferromagnetic heavy fermion materials have revealed that quantum criticality has several classes, with an unconventional type that involves a critical destruction of the Kondo entanglement. In order to understand such varieties, it is important to extend the materials basis beyond the usual setting of intermetallic compounds. Here we show that a nickel oxypnictide, CeNiAsO, displays a heavy-fermion antiferromagnetic quantum critical point as a function of either pressure or P/As substitution. At the quantum critical point, non-Fermi liquid behavior appears, which is accompanied by a divergent effective carrier mass. Across the quantum critical point, the low-temperature Hall coefficient undergoes a rapid sign change, suggesting a sudden jump of the Fermi surface and a destruction of the Kondo effect. Our results imply that the enormous materials basis for the oxypnictides, which has been so crucial to the search for high temperature superconductivity, will also play a vital role in the effort to establish the universality classes of quantum criticality in strongly correlated electron systems.

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arXiv2014

Nematic spin correlations in the tetragonal state of uniaxial strained BaFe2-xNixAs2

Understanding the microscopic origins of electronic phases in high-transition temperature (high-Tc) superconductors is important for elucidating the mechanism of superconductivity. In the paramagnetic tetragonal phase of BaFe2-xTxAs2 (where T is Co or Ni) iron pnictides, an in-plane resistivity anisotropy has been observed. Here we use inelastic neutron scattering to show that low-energy spin excitations in these materials change from four-fold symmetric to two-fold symmetric at temperatures corresponding to the onset of the in-plane resistivity anisotropy. Because resistivity and spin excitation anisotropies both vanish near optimal superconductivity, we conclude that they are likely intimately connected.

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arXiv2014

The role of 245 phase in alkaline iron selenide superconductors revealed by high pressure studies

Here we show that a pressure of about 8 GPa suppresses both the vacancy order and the insulating phase, and a further increase of the pressure to about 18 GPa induces a second transition or crossover. No superconductivity has been found in compressed insulating 245 phase. The metallic phase in the intermediate pressure range has a distinct behavior in the transport property, which is also observed in the superconducting sample. We interpret this intermediate metal as an orbital selective Mott phase (OSMP). Our results suggest that the OSMP provides the physical pathway connecting the insulating and superconducting phases of these iron selenide materials.

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arXiv2013

Quantum criticality in the pseudogap Bose-Fermi Anderson and Kondo models: Interplay between fermion- and boson-induced Kondo destruction

We address the phenomenon of critical Kondo destruction in pseudogap Bose-Fermi Anderson and Kondo quantum impurity models. These models describe a localized level coupled both to a fermionic bath having a density of states that vanishes like |ε|^r at the Fermi energy (ε=0) and, via one component of the impurity spin, to a bosonic bath having a sub-Ohmic spectral density proportional to |ω|^s. Each bath is capable by itself of suppressing the Kondo effect at a continuous quantum phase transition. We study the interplay between these two mechanisms for Kondo destruction using continuous-time quantum Monte Carlo for the pseudogap Bose-Fermi Anderson model with 0<r<1/2 and 1/2<s<1, and applying the numerical renormalization-group to the corresponding Kondo model. At particle-hole symmetry, the models exhibit a quantum critical point between a Kondo (fermionic strong-coupling) phase and a localized (Kondo-destroyed) phase. The two solution methods, which are in good agreement in their domain of overlap, provide access to the many-body spectrum, as well as to correlation functions including, in particular, the single-particle Green's function and the static and dynamical local spin susceptibilities. The quantum-critical regime exhibits the hyperscaling of critical exponents and ω/T scaling in the dynamics that characterize an interacting critical point. The (r,s) plane can be divided into three regions: one each in which the calculated critical properties are dominated by the bosonic bath alone or by the fermionic bath alone, and between these two regions, a third in which the bosonic bath governs the critical spin response but both baths influence the renormalization-group flow near the quantum critical point.

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