arXiv subjects

Claudia Felser

Publications and source records attributed to Claudia Felser.

At least 325 records · Page 18Linked to original sources

arXiv2016

Mesoscopic superconductivity and high spin polarization coexisting at metallic point contacts on the Weyl semimetal TaAs

A Weyl semimetal is a topologically non-trivial phase of matter that hosts mass-less Weyl fermions, the particles that remained elusive for more than 80 years since their theoretical discovery. The Weyl semimetals exhibit unique transport and magneto-transport properties and remarkably high surface spin polarization. Here we show that a unique mesoscopic superconducting phase with a critical temperature up to 7 K can be realized by forming metallic point contacts with silver (Ag) on single crystals of TaAs, while neither Ag nor TaAs are superconductors. The Andreev reflection spectra obtained from such point contacts are fitted well within a modified Blonder-Tinkham-Klapwijk (BTK) model with a superconducting energy gap up to 1.2 meV. The analysis within this model also reveals high transport spin polarization up to 60\% indicating a spin polarized supercurrent flowing through the point contacts on TaAs. Such point contacts also show a large anisotropic magnetoresistance (AMR) originating from the spin polarized current. Therefore, apart from the discovery of a novel mesoscopic superconducting phase and it's coexistence with a large spin polarization, our results also show that the point contacts on Weyl semimetals are potentially important for applications in spintronics.

cond-mat.supr-con↗

arXiv2016

Active role of the nonmagnetic cations in magnetic interactions for the double-perovskite Sr2BOsO6 (B=Y, In, Sc)

Using first-principles density functional theory, we have investigated the electronic and magnetic properties of recently synthesized and characterized 5d double-perovskites Sr2BOsO6 (B=Y, In, Sc). The electronic structure calculations show that in all compounds, the Os5+ (5d3) site is the only magnetically active one, while Y3+, In3+ and Sc3+ remain in nonmagnetic states, with Sc/Y and In featuring d0 and d10 electronic configurations, respectively. Our studies reveal the important role of closed-shell (d10) versus open-shell (d0) electronic configurations of the nonmagnetic sites in determining the overall magnetic exchange interactions. Although the magnetic Os5+ (5d3) site is the same in all compounds, the magnetic super-exchange interactions mediated by non-magnetic Y/In/Sc species are strongest for Sr2ScOsO6, weakest for Sr2InOsO6, and intermediate in case of the Y (d0), due to different energy overlaps between Os-5d and Y/In/Sc-d states. This explains the experimentally observed substantial differences in the magnetic transition temperatures of these materials, despite of an identical magnetic site and underlying magnetic ground state. Furthermore, short range Os-Os exchange-interactions are more prominent than long range Os-Os interactions in these compounds, which contrasts with the behavior of other 3d-5d double-perovskites.

cond-mat.str-el↗

arXiv2016

Magnetic properties and Curie temperatures of disordered Heusler compounds: Co(1+x)Fe(2-x)Si

The local atomic environments and magnetic properties were investigated for a series of Co(1+x)Fe(2-x)Si (0<x<1) Heusler compounds. While the total magnetic moment in these compounds increases with the number of valance electrons, the highest Curie temperature (Tc) in this series was found for Co1.5Fe1.5Si, with a Tc of 1069 K (24 K higher than the well known Co2FeSi). 57Fe Mössbauer spectroscopy was used to characterize the local atomic order and to estimate the Co and Fe magnetic moments. Consideration of the local magnetic moments and the exchange integrals is necessary to understand the trend in Tc.

cond-mat.mtrl-sci↗

arXiv2016

Large anomalous Hall effect driven by non-vanishing Berry curvature in non-collinear antiferromagnetic Mn3Ge

It is well established that the anomalous Hall effect that a ferromagnet displays scales with its magnetization. Therefore, an antiferromagnet that has no net magnetization should exhibit no anomalous Hall effect. Here we show that the non-collinear triangular antiferromagnet Mn3Ge exhibits a large anomalous Hall effect comparable to that of ferromagnetic metals; the magnitude of the anomalous conductivity is 500 per ohm per cm at 2 K and 50 per ohm per cm at room temperature. The angular dependence of the anomalous Hall effect measurements confirm that the small residual in-plane magnetic moment has no role in the observed effect. Our theoretical calculations demonstrate that the large anomalous Hall effect in Mn3Ge originates from a non-vanishing Berry curvature that arises from the chiral spin structure, and which also results in a large spin Hall effect, comparable to that of platinum. The present results pave the way to realize room temperature antiferromagnetic spintronics and spin Hall effect based data storage devices.

cond-mat.str-el↗

arXiv2016

The role of ionized impurity scattering on the thermoelectric performances of rock salt AgPbmSnSe2+m

We report on the successful synthesis and on the properties of polycrystalline AgPbmSnSe2+m (m = ++++, 100, 50, 25) samples with a rock salt structure. Between 160 K and 400 K, the dominant scattering process of the carriers in this system changes from acoustic phonon scattering in PbSe to ionized impurity scattering in AgPbmSnSe2+m, which synergistically optimizes electrical and thermal transport properties. Thanks to the faint amount of AgSnSe2, the Seebeck coefficient is enhanced by boosting the scattering factor, the electric conductivity is improved by the increase of the concentration of holes coupled to a limited degradation of their mobility, and the total thermal conductivity is reduced by suppressing bipolar thermal conductivity. Therefore, ZT of AgPbmSnSe2+m (m = 50) reaches 1.3 at 889 K. The mechanism suggested in this study opens new paths to improve the thermoelectric performances of other families of materials.

cond-mat.mtrl-sci↗

arXiv2016

Observation of pseudo two dimensional electron transport in the rock salt type topological semimetal LaBi

Topological insulators are characterized by an inverted band structure in the bulk and metallic surface states on the surface. In LaBi, a semimetal with a band inversion equivalent to a topological insulator, we observe surface state like behavior in the magnetoresistance. The electrons responsible for this pseudo two dimensional transport, however, originate from the bulk states rather topological surface states, which is witnessed by the angle dependent quantum oscillations of the magnetoresistance and ab initio calculations. As a consequence, the magnetoresistance exhibits strong anisotropy with large amplitude (~ 10^5 %).

cond-mat.mtrl-sci↗

arXiv2016

Chiral Quasiparticles at the Fermi Surface of the Weyl Semimetal TaAs

Tantalum arsenide is a member of the non-centrosymmetric monopnictides, which are putative Weyl semimetals. In these materials, three-dimensional chiral massless quasiparticles, the so-called Weyl fermions, are predicted to induce novel quantum mechanical phenomena, such as the chiral anomaly and topological surface states. However, their chirality is only well-defined if the Fermi level is close enough to the Weyl points that separate Fermi surface pockets of opposite chirality exist. In this article, we present the bulk Fermi surface topology of high quality single crystals of TaAs, as determined by angle-dependent Shubnikov-de Haas and de Haas-van Alphen measurements combined with ab-initio band-structure calculations. Quantum oscillations originating from three different types of Fermi surface pocket were found in magnetization, magnetic torque, and mag- netoresistance measurements performed in magnetic fields up to 14 T and temperatures down to 1.8 K. Of these Fermi pockets, two are pairs of topologically non-trivial electron pockets around the Weyl points and one is a trivial hole pocket. Unlike the other members of the non-centrosymmetric monopnictides, TaAs is the first Weyl semimetal candidate with the Fermi energy suffciently close to both types of Weyl points to generate chiral quasiparticles at the Fermi surface.

cond-mat.mtrl-sci↗

arXiv2016

Superconductivity in Weyl Semimetal Candidate MoTe2

In recent years, layered transition-metal dichalcogenides (TMDs) have attracted considerable attention because of their rich physics; for example, these materials exhibit superconductivity, charge density waves, and the valley Hall effect. As a result, TMDs have promising potential applications in electronics, catalysis, and spintronics. Despite the fact that the majority of related research focuses on semiconducting TMDs (e.g., MoS2), the characteristics of WTe2 are provoking strong interest in semimetallic TMDs with extremely large magnetoresistance, pressure-driven superconductivity, and the predicted Weyl semimetal (WSM) state. In this work, we investigate the sister compound of WTe2, MoTe2, which is also predicted to be a WSM and a quantum spin Hall insulator in bulk and monolayer form, respectively. We find that MoTe2 exhibits superconductivity with a resistive transition temperature Tc of 0.1 K. The application of a small pressure (such as 0.4 GPa) is shown to dramatically enhance the Tc, with a maximum value of 8.2 K being obtained at 11.7 GPa (a more than 80-fold increase in Tc). This yields a dome-shaped superconducting phase diagram. Further explorations into the nature of the superconductivity in this system may provide insights into the interplay between strong correlations and topological physics.

cond-mat.mtrl-sci↗

arXiv2016

Visualizing "Fermi arcs" in the Weyl semimetal TaAs

One of the hallmarks of Weyl semi-metals is the existence of unusual topological surface states known as 'Fermi arcs' [1-3]. The formation of these states is guaranteed by the existence of bulk Weyl points with opposite chirality. Tantalum Arsenide (TaAs) [4-9], a member of the newly discovered family of Weyl semi-metals [4,5], harbors a host of non-topological ('trivial') surface states overlapping in energy with the predicted 12 'Fermi arcs'. This overlap poses a major challenge in identifying the signatures of the arcs [10]. Here we harness the inherently distinct spatial structure of trivial and Fermi arc states to visualize the Fermi arcs for the first time using scanning tunneling microscopy. We do so in four distinct ways, each of which highlights a different aspect of their unusual nature. We reveal their relatively isotropic scattering signature, their energy dispersion and its relation to the bulk Weyl points, their deep bulk penetration relative to that of non-topological surface states and their weak coupling to the atomic structure. The latter is obtained by accounting for the spatial structure of the Bloch wavefunction and its effect on the scattering properties of the electrons off lattice defects in general. It thus provides a novel analysis tool for the spectroscopic characterization of electronic wavefunctions using scanning tunneling microscopy.

cond-mat.mes-hall↗

arXiv2016

Rectangular Tantalum Carbide Halides TaCX (X = Cl, Br, I) monolayer: Novel Large-Gap Quantum Spin Hall Insulator

Quantum spin Hall (QSH) insulators possess edge states that are topologically protected from backscattering. However, known QSH materials (e.g. HgTe/CdTe and InAs/GaSb quantum wells) exhibit very small energy gap and only work at low temperature, hindering their applications for room temperature devices. Based on the first-principles calculations, we predict a novel family of QSH insulators in monolayer tantalum carbide halide TaCX (X = Cl, Br, and I) with unique rectangular lattice and large direct energy gaps larger than 0.2 eV, accurately, 0.23$-$0.36 eV. The mechanism for 2D QSH effect in this system originates from a intrinsic d$-$d band inversion, different from conventional QSH systems with band inversion between s$-$p or p$-$p orbitals. Further, stain and intrinsic electric field can be used to tune the electronic structure and enhance the energy gap. TaCX nanoribbon, which has single-Dirac-cone edge states crossing the bulk band gap, exhibits a linear dispersion with a high Fermi velocity comparable to that of graphene. These 2D materials with considerable nontrivial gaps promise great application potential in the new generation of dissipationless electronics and spintronics.

cond-mat.mtrl-sci↗

arXiv2016

Pressure-driven Superconductivity in Transition-metal Pentatelluride HfTe5

Layered transition-metal tellurides have attracted considerable attention because of their rich physics; for example, tungsten ditelluride WTe2 exhibits extremely large magnetoresistance; the tritelluride ZrTe3 shows a charge density wave transition at low temperature; and the pentatelluride ZrTe5 displays an enigmatic resistivity anomaly and large thermoelectric power. Recently some transition-metal tellurides are predicted to be quantum spin Hall insulators (e.g. ZrTe5 and HfTe5) or Weyl semimetals (e.g. WTe2 and MoTe2) and were subjected to intensive investigations. Here, we report on the discovery of superconductivity in hafnium pentatelluride HfTe5 under high pressure. We observe two structural phase transitions and metallization with superconductivity developing at around 5 GPa. A maximal critical temperature of 4.8 K is attained at a pressure of 20 GPa, and superconductivity persists up to the maximum pressure in our study (42 GPa). Theoretical calculations indicate that the superconductivity develops mainly in the Te atom layers at medium pressure and in the Te atom chains at high pressure.

cond-mat.supr-con↗

arXiv2016

Observation of Unusual Topological Surface States in Half-Heusler Compounds LnPtBi (Ln=Lu, Y)

Topological quantum materials represent a new class of matter with both exotic physical phenomena and novel application potentials. Many Heusler compounds, which exhibit rich emergent properties such as unusual magnetism, superconductivity and heavy fermion behaviour, have been predicted to host non-trivial topological electronic structures. The coexistence of topological order and other unusual properties makes Heusler materials ideal platform to search for new topological quantum phases (such as quantum anomalous Hall insulator and topological superconductor). By carrying out angle-resolved photoemission spectroscopy (ARPES) and ab initio calculations on rare-earth half-Heusler compounds LnPtBi (Ln=Lu, Y), we directly observed the unusual topological surface states on these materials, establishing them as first members with non-trivial topological electronic structure in this class of materials. Moreover, as LnPtBi compounds are non-centrosymmetric superconductors, our discovery further highlights them as promising candidates of topological superconductors.

cond-mat.mtrl-sci↗

arXiv2016

Quantum oscillations and the Fermi-surface topology of the Weyl semimetal NbP

The Weyl semimetal NbP was found to exhibit topological Fermi arcs and exotic magneto-transport properties. Here, we report on magnetic quantum-oscillation measurements on NbP and construct the 3D Fermi surface with the help of band-structure calculations. We reveal a pair of spin-orbit-split electron pockets at the Fermi energy and a similar pair of hole pockets, all of which are strongly anisotropic. The Fermi surface well explains the linear magnetoresistance observed in high magnetic fields by the quantum-limit scenario. The Weyl points that are located in the $k_z \approx π/c$ plane are found to exist 5 meV above the Fermi energy. Therefore, we predict that the chiral anomaly effect can be realized in NbP by electron doping to drive the Fermi energy to the Weyl points.

cond-mat.mtrl-sci↗

arXiv2016

Negative magnetoresistance without well-defined chirality in the Weyl semimetal TaP

Weyl semimetals (WSMs) are topological quantum states wherein the electronic bands linearly disperse around pairs of nodes, the Weyl points, of fixed (left or right) chirality. The recent discovery of WSM materials triggered an experimental search for the exotic quantum phenomenon known as the chiral anomaly. Via the chiral anomaly nonorthogonal electric and magnetic fields induce a chiral density imbalance that results in an unconventional negative longitudinal magnetoresistance, the chiral magnetic effect. Recent theoretical work suggests that this effect does not require well-defined Weyl nodes. Experimentally however, it remains an open question to what extent it survives when chirality is not well-defined, for example when the Fermi energy is far away from the Weyl points. Here, we establish the detailed Fermi surface topology of the recently identified WSM TaP via a combination of angle-resolved quantum oscillation spectra and band structure calculations. The Fermi surface forms spin-polarized banana-shaped electron and hole pockets attached to pairs of Weyl points. Although the chiral anomaly is therefore ill-defined, we observe a large negative magnetoresistance (NMR) appearing for collinear magnetic and electric fields as observed in other WSMs. In addition, we show experimental signatures indicating that such longitudinal magnetoresistance measurements can be affected by an inhomogeneous current distribution inside the sample in a magnetic field. Our results provide a clear framework how to detect the chiral magnetic effect.

cond-mat.mtrl-sci↗

arXiv2016

Behavior of $\mathbf{Σ3}$ grain boundaries in \CISe\ and \CGSe\ photovoltaic absorbers as revealed by first-principles hybrid functional calculations

The inconclusive results of the previous first-principles studies on the \S3 \ grain boundaries (GBs) in \CISe\ reveal the importance of employing a method that can correctly describe the electronic structure of this solar-cell material. We have employed hybrid functional calculations to study the \S3 (112) and \S3 (114) GBs in \CISe\ and \CGSe. The electronic structure changes introduced by the formation of GBs are threefold: creation of gap states, shift in band edges, and alteration of bandgap sizes. Gap states commonly behave as recombination centers, but the band alignment and the change in the bandgap size induced by GBs mitigate the destructive effect of these states in \CISe. That means, \S3 \ GBs are not detrimental for the carrier transport in devices based on \CISe. Conversely, these GBs are destructive for the carrier transport in \CGSe. The different behaviors of the \S3 \ GBs in CISe and CGSe might be considered by experimentalists to optimize the device fabrication to achieve high-performance solar cells.

cond-mat.mtrl-sci↗

arXiv2015

New Family of Quantum Spin Hall Insulators in Two-dimensional Transition-Metal Halide with Large Nontrivial Band Gaps

Topological insulators (TIs) are promising for achieving dissipationless transport devices due to the robust gapless states inside the insulating bulk gap. However, currently realized 2D TIs, quantum spin Hall (QSH) insulators, suffer from ultra-high vacuum and extremely low temperature. Thus, seeking for desirable QSH insulators with high feasibility of experimental preparation and large nontrivial gap is of great importance for wide applications in spintronics. Based on the first-principles calculations, we predict a novel family of two-dimensional (2D) QSH insulators in transition-metal halide MX (M = Zr, Hf; X = Cl, Br, and I) monolayers with large nontrivial gaps of 0.12$-$0.4 eV, comparable with bismuth (111) bilayer (0.2 eV), stanene (0.3 eV) and larger than ZrTe$_5$ (0.1 eV) monolayers and graphene-based sandwiched heterstructures (30$-$70 meV). Their corresponding 3D bulk materials are weak topological insulators from stacking QSH layers, and some of bulk compounds have already been synthesized in experiment. The mechanism for 2D QSH effect in this system originates from a novel d$-$d band inversion, which is different from conventional band inversion between s$-$s orbitals, or p$-$p orbitals. The realization of pure layered MX monolayers may be prepared by exfoliation from their 3D bulk phases, thus holding great promise for nanoscale device applications and stimulating further efforts on transition metal-based QSH materials.

cond-mat.mtrl-sci↗

arXiv2015

Intercalation effect on hyperfine parameters of Fe in FeSe superconductor with Tc = 42 K

57Fe-Mossbauer spectra of superconducting beta-FeSe, the Li/NH3 intercalate product and a subsequent sample of this intercalate treated with moist He gas have been measured in temperature range 4.7 - 290 K. A correlation is established between hyperfine parameters and critical temperature Tc in these phases. A strong increase of isomer shift upon intercalation is explained by a charge transfer from the Li/NH3 intercalate to the FeSe layers resulting in an increase of Tc up to 42 K. A significant decrease of the quadrupole splitting above 240 K has been attributed to diffusive motion of Li+ ions within the interlamellar space.

cond-mat.supr-con↗

arXiv2015

Prediction of the Weyl semimetal in the orthorhombic MoTe2

We investigate the orthorhombic phase (Td) of layered transition-metal-dichalcogenide MoTe$_2$ as a Weyl semimetal candidate, which was discovered to be a superconductor in our recent experiment. MoTe$_2$ exhibits four pairs of Weyl points lying slightly ($\sim$ 6 meV) above the Fermi energy in the bulk band structure. Unlike its cousin WTe$_2$, which was predicted to be a type-II Weyl semimetal recently, the spacing between each pair of Weyl points is found to be as large as 4 percent of the reciprocal lattice in MoTe$_2$ (six times larger than that of WTe$_2$). When projected to the surface, Weyl points are connected by Fermi arcs, which can be easily verified by ARPES due to the large Weyl point separation. In addition, we show that the correlation effect or strain can drive MoTe$_2$ from the type-II to type-I Weyl semimetal.

cond-mat.mtrl-sci↗