arXiv subjects

I. I. Mazin

Publications and source records attributed to I. I. Mazin.

At least 91 records · Page 5Linked to original sources

arXiv2013

Why MgFeGe is not a superconductor

The recently synthesized MgFeGe compound is isostructural and isoelectronic with superconducting LiFeAs. Both materials are paramagnetic metals at room temperature. Inspection of their electronic structures without spin polarization reveals hardly any difference between the two. This fact was interpreted as evidence against popular theories relating superconductivity in Fe-based materials with spin fluctuations. We show that in the magnetic domain the two compounds are dramatically different, and the fact that MgFeGe does not superconduct, is, on the contrary, a strong argument in favor of theories based on spin fluctuations.

cond-mat.str-el↗

arXiv2013

Sign-reversal of the in-plane resistivity anisotropy in hole-doped iron pnictides

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 doping level increases, the resistivity anisotropy initially becomes vanishingly small, and eventually changes sign for sufficiently large doping, i. e. $ρ_{b}<ρ_{a}$. This observation is in agreement with a recent theoretical prediction that considers the anisotropic scattering of electrons by spin-fluctuations in the orthorhombic/nematic state.

cond-mat.supr-con↗

arXiv2013

Comment on "Unified Formalism of Andreev Reflection at a Ferromagnet/Superconductor Interface" by T.Y. Chen, et al

A recent paper of Chen et al. claims to have derived an allegedly previously unavailable "unified" Andreev Reflection (AR) formalism for an arbitrary spin polarization P that recovers earlier results as its special limits. In this Comment we show that, contrary to this claim, there are numerous works correctly solving the problem formulated in this paper for an arbitrary P, while Chen et al formulas fail to correctly incorporate P \neq 0 effects and violate basic physical principles.

cond-mat.supr-con↗

arXiv2012

Na2IrO3 as a molecular orbital crystal

Contrary to previous studies that classify Na2IrO3 as a realization of the Heisenberg-Kitaev model with dominant spin-orbit coupling, we show that this system represents a highly unusual case in which the electronic structure is dominated by the formation of quasi-molecular orbitals (QMOs), with substantial quenching of the orbital moments. The QMOs consist of six atomic orbitals on an Ir hexagon, but each Ir atom belongs to three different QMOs. The concept of such QMOs in solids invokes very different physics compared to the models considered previously. Employing density functional theory calculations and model considerations we find that both the insulating behavior and the experimentally observed zigzag antiferromagnetism in Na2IrO3 naturally follow from the QMO model.

cond-mat.str-el↗

arXiv2012

Designing phase-sensitive tests for Fe-based superconductors

We suggest new experimental designs suitable to test pairing symmetry in multiband Fe-based superconductors. These designs are based on combinations of tunnel junctions and point contacts and should be accessible by existing sample fabrication techniques.

cond-mat.supr-con↗

arXiv2012

Accounting for spin fluctuations beyond LSDA in the density functional theory

We present a method to correct the magnetic properties of itinerant systems in local spin density approximation (LSDA) and we apply it to the ferromagnetic-paramagnetic transition under pressure in a typical itinerant system, Ni$_{3}$Al. We obtain a scaling of the critical fluctuations as a function of pressure equivalent to the one obtained within Moryia's theory. Moreover we show that in this material the role of the bandstructure is crucial in driving the transition. Finally we calculate the magnetic moment as a function of pressure, and find that it gives a scaling of the Curie temperature that is in good agreement with the experiment. The method can be easily extended to the antiferromagnetic case and applied, for instance, to the Fe-pnictides in order to correct the LSDA magnetic moment.

cond-mat.str-el↗

arXiv2012

Structural and Electronic Properties of the 2D Superconductor CuS with 1 1/3-valent Copper

We present first principle calculations of the structural and electronic properties of the CuS covellite material. Symmetry-lowering structural transition is well reproduced. However, the microscopic origin of the transition is unclear. The calculations firmly establish that the so far controversial Cu valency in this compound is 1.33. We also argue that recently reported high-temperature superconductivity in CuS is unlikely to occur in the stoichiometric defect-free material, since the determined Cu valency is too close to 1 to ensure proximity to a Mott-Hubbard state and superexchange spin fluctuations of considerable strength. On the other hand, one can imagine a related system with more holes per Cu in the same structural motif ($e.g.$, due to defects or O impurities) in which case combination of superexchange and an enlarged compared to CuS Fermi surface may lead to unconventional superconductivity, similar to HTSC cuprates, but, unlike them, of an $f$-wave symmetry.

cond-mat.mtrl-sci↗

arXiv2011

A de Haas-van Alphen study of the Fermi surfaces of superconducting LiFeP and LiFeAs

We report a de Haas-van Alphen (dHvA) oscillation study of the 111 iron pnictide superconductors LiFeAs with T_c ~18K and LiFeP with T_c~5K. We find that for both compounds the Fermi surface topology is in good agreement with density functional band-structure calculations and shows quasi-nested electron and hole bands. The effective masses generally show significant enhancement, up to ~3 for LiFeP and ~5 for LiFeAs. However, one hole Fermi surface in LiFeP shows a very small enhancement, as compared with its other sheets. This difference probably results from k-dependent coupling to spin fluctuations and may be the origin of the different nodal and nodeless superconducting gap structures in LiFeP and LiFeAs respectively.

cond-mat.supr-con↗

arXiv2011

Gap symmetry and structure of Fe-based superconductors

The recently discovered Fe-pnictide and chalcogenide superconductors display low-temperature properties suggesting superconducting gap structures which appear to vary substantially from family to family, and even within families as a function of doping or pressure. We propose that this apparent nonuniversality can actually be understood by considering the predictions of spin fluctuation theory and accounting for the peculiar electronic structure of these systems, coupled with the likely 'sign-changing s-wave' (s\pm) symmetry. We review theoretical aspects, materials properties and experimental evidence relevant to this suggestion, and discuss which further measurements would be useful to settle these issues.

cond-mat.supr-con↗

arXiv2011

Common Fermi-liquid origin of T-squared resistivity and superconductivity in n-type SrTiO3

A detailed analysis is given of the T^2 term in the resistivity observed in electron-doped SrTiO3. Novel bandstructure data are presented, which provide values for the bare mass, density of states, and plasma frequency of the quasiparticles as a function of doping. It is shown that these values are renormalized by approximately a factor 2 due to electron-phonon interaction. It is argued that the quasiparticles are in the anti-adiabatic limit with respect to electron-phonon interaction. The condition of anti-adiabatic coupling renders the interaction mediated through phonons effectively non-retarded. We apply Fermi-liquid theory developed in the 70's for the T^2 term in the resistivity of common metals, and combine this with expressions for Tc and with the Brinkman-Platzman-Rice (BPR) sum-rule to obtain Landau parameters of n-type SrTiO3. These parameters are comparable to those of liquid 3He, indicating interesting parallels between these Fermi-liquids despite the differences between the composite fermions from which they are formed.

cond-mat.str-el↗

arXiv2011

Reply to Comment by Borisenko et al. on article `A de Haas-van Alphen study of the Fermi surfaces of superconducting LiFeP and LiFeAs'

Recently, Borisenko et al have posted a Comment (arXiv:1108.1159) where they suggest an alternative interpretation of our de Haas-van Alphen (dHvA) measurements on the superconductor LiFeAs. In our original paper (arXiv:1107.4375) we concluded that our measurements of the bulk Fermi surface were not consistent with the surface bands observed thus far by ARPES. Borisenko et al dispute this and suggest the two measurements are consistent if some of the orbits we observe are due to magnetic breakdown. We argue here that this scenario is inconsistent with the experimental data and therefore that our original conclusion stands.

cond-mat.supr-con↗

arXiv2011

Symmetry analysis of possible superconducting states in KxFe2Se2 superconductors

A newly discovered family of the Fe-based superconductors is isostructural with the so-called 122 family of Fe pnictides, but has a qualitatively different doping state. Early experiments indicate that superconductivity is nodeless, yet prerequisites for the $s_\pm$ nodeless state (generally believed to be realized in Fe superconductors) are missing. It is tempting to assign a $d-$ wave symmetry to the new materials, and it does seem at first glance that such a state may be nodeless. Yet a more careful analysis shows that it is not possible, given the particular 122 crystallography, and that the possible choice of admissible symmetries is severly limited: it is either a conventional single-sign $s_{+}$ state, or another $s_\pm$ state, different from the one believed to be present in other Fe-based superconductors.

cond-mat.supr-con↗

arXiv2011

Quasiparticle interference in antiferromagnetic parent compounds of Fe-based superconductors

Recently reported quasiparticle interference imaging in underdoped Ca(Fe{1-x}Co{x})_2As{2} shows pronounced C{2} asymmetry that is interpreted as an indication of an electronic nematic phase with a unidirectional electron band, dispersive predominantly along the $b$-axis of this orthorhombic material. On the other hand, even more recent transport measurements on untwinned samples show near isotropy of the resistivity in the $ab$ plane, with slightly larger conductivity along a (and not b). We show that in fact both sets of data are consistent with the calculated ab initio Fermi surfaces, which has a decisively broken C_{4}, and yet similar Fermi velocity in both directions. This reconciles completely the apparent contradiction between the conclusions of the STM and the transport experiments.

cond-mat.supr-con↗

arXiv2010

Competition between Electron-Phonon coupling and Spin Fluctuations in superconducting hole-doped BiOCuS

BiOCuS is a band insulator that becomes metallic upon hole doping. Superconductivity was recently reported in doped BiOCu$_{1-x}$S and attributed to spin fluctuations as a pairing mechanism. Based on first principles calculations of the electron-phonon coupling, we argue that the latter is very strong in this material, and probably drives superconductivity, which is however strongly depressed by the proximity to magnetism. We find however that BiOCu$_{1-x}$S is a quite unique compound where both a conventional phonon-driven and an unconventional triplet superconductivity are possible, and compete with each other. We argue that, in this material, it should be possible to switch from conventional to unconventional superconductivity by varying such parameters as doping or pressure.

cond-mat.supr-con↗

arXiv2010

Direct observation of charge order in triangular metallic AgNiO2 by single-crystal resonant X-ray scattering

We report resonant X-ray scattering measurements on the orbitally-degenerate triangular metallic antiferromagnet 2H-AgNiO2 to probe the spontaneous transition to a triple-cell superstructure at temperatures below 365 K. We observe a strong resonant enhancement of the supercell reflections through the Ni K-edge. The empirically extracted K-edge shift between the crystallographically-distinct Ni sites of 2.5(3) eV is much larger than the value expected from the shift in final states, and implies a core-level shift of ~1 eV, thus providing direct evidence for the onset of spontaneous honeycomb charge order in the triangular Ni layers. We also provide band-structure calculations that explain quantitatively the observed edge shifts in terms of changes in the Ni electronic energy levels due to charge order and hybridization with the surrounding oxygens.

cond-mat.str-el↗

arXiv2010

Pinpointing Gap Minima in Ba(Fe$_{0.94}$Co$_{0.06})_{2}$As$_2$ \textit{via} Band Structure Calculations and Electronic Raman Scattering

A detailed knowledge of the gap structure for the Fe-pnictide superconductors is still rather rudimentary, with several conflicting reports of either nodes, deep gap minima, or fully isotropic gaps on the Fermi surface sheets, both in the $k_{x}-k_{y}$ plane and along the c-axis. In this paper we present considerations for electronic Raman scattering which can help clarify the gap structure and topology using different light scattering geometries. Using density functional calculations for the Raman vertices, it is shown that the location of the gap minima may occur on loops stretching over a portion of the c-axis in Ba(Fe$_{0.94}$Co$_{0.06})_{2}$As$_2$.

cond-mat.supr-con↗

arXiv2010

Anisotropic Structure of the Order Parameter in FeSe_{0.4}Te_{0.6} Revealed by Angle Resolved Specific Heat

The symmetry and structure of the superconducting gap in the Fe-based superconductor are the central issue for understanding these novel materials. So far the experimental data and theoretical models have been highly controversial. Some experiments favor two or more constant or nearly-constant gaps, others indicate strong anisotropy and yet others suggest gap zeros ("nodes"). Theoretical models also vary, suggesting that the absence or presence of the nodes depends quantitatively on the model parameters. An opinion that has gained substantial currency is that the gap structure, unlike all other known superconductors, including cuprates, may be different in different compounds within the same family. A unique method for addressing this issue, one of the very few methods that are bulk and angle-resolved, calls for measuring the electronic specific heat in a rotating magnetic field, as a function of field orientation with respect to the crystallographic axes. In this Communication we present the first such measurement for an Fe-based high-Tc superconductor (FeBSC). We observed a fourfold oscillation of the specific heat as a function of the in-plane magnetic field direction, which allowed us to identify the locations of the gap minima (or nodes) on the Fermi surface. Our results place severe restrictions on the gap structure and on the existing theoretical models.

cond-mat.supr-con↗

arXiv2010

Anisotropic Structure of the Order Parameter in FeSe0.45Te0.55 Revealed by Angle Resolved Specific Heat

The symmetry and structure of the superconducting gap in the Fe-based superconductors are the central issue for understanding these novel materials. So far the experimental data and theoretical models have been highly controversial. Some experiments favor two or more constant or nearly-constant gaps, others indicate strong anisotropy and yet others suggest gap zeros ("nodes"). Theoretical models also vary, suggesting that the absence or presence of the nodes depends quantitatively on the model parameters. An opinion that has gained substantial currency is that the gap structure, unlike all other known superconductors, including cuprates, may be different in different compounds within the same family. A unique method for addressing this issue, one of the very few methods that are bulk and angle-resolved, calls for measuring the electronic specific heat in a rotating magnetic field, as a function of field orientation with respect to the crystallographic axes. In this Communication we present the first such measurement for an Fe-based high-Tc superconductor (FeBSC). We observed a fourfold oscillation of the specific heat as a function of the in-plane magnetic field direction, which allowed us to identify the locations of the gap minima (or nodes) on the Fermi surface. Our results are consistent with the expectations of an extended s-wave model with a significant gap anisotropy on the electron pockets and the gap minima along the ΓM (or Fe-Fe bond) direction.

cond-mat.supr-con↗