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David Mandrus

Publications and source records attributed to David Mandrus.

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Iron substitution in NdCoAsO: crystal structure and magnetic phase diagram

The effects of replacing small amounts of Co with Fe in NdCoAsO are reported. Polycrystalline materials with compositions NdCo1-xFexAsO (x = 0.05, 0.10, 0.15, and 0.20) are studied and the results compared to previous reports for NdCoAsO. Rietveld analysis of powder x-ray diffraction data shows that as Fe replaces Co on the transition metal (T) site, the T-As distance increases, and the As tetrahedra surrounding the T-site become more regular. Electrical resistivity and magnetization measurements indicate that the three magnetic phase transitions in NdCoAsO are suppressed as Co is replaced by Fe, and these transitions are not observed above 1.8 K for x = 0.20. Based on these results, the magnetic phase diagram for the Co-rich side of the NdCoAsO-NdFeAsO system is constructed.

cond-mat.str-el↗

Effects of nematic fluctuations on the elastic properties of iron arsenide superconductors

We demonstrate that the changes in the elastic properties of the FeAs systems, as seen in our resonant ultrasound spectroscopy data, can be naturally understood in terms of fluctuations of emerging nematic degrees of freedom. Both the softening of the lattice in the normal, tetragonal phase as well as its hardening in the superconducting phase are consistently described by our model. Our results confirm the view that structural order is induced by magnetic fluctuations.

cond-mat.supr-con↗

Magnetic Phase Transitions in NdCoAsO

Magnetization measurements reveal that NdCoAsO undergoes three magnetic phase transitions below room temperature. The crystal and magnetic structures of NdCoAsO have been determined by powder neutron diffraction, and the effects of the phase transitions on physical properties are reported. Near 69 K a ferromagnetic state emerges with a small saturation moment of about 0.2 Bohr magnetons, likely on Co atoms. At 14 K the material enters an antiferromagnetic state with propagation vector (0 0 1/2) and small ordered moments (~0.4 Bohr magnetons) on Co and Nd. Near 3.5 K a third transition is observed, and corresponds to the antiferromagnetic ordering, with the same propagation vector, of larger moments on Nd reaching 1.30(2) Bohr magnetons at 1.4 K. In addition, transport properties and heat capacity results are presented, and show anomalies at all three phase transitions.

cond-mat.supr-con↗

A Model of the Normal State Susceptibility and Transport Properties of Ba(Fe1-xCox)2As2: Why does the magnetic susceptibility increase with temperature?

A simple two-band model is used to describe the magnitude and temperature dependence of the magnetic susceptibility, Hall coefficient and Seebeck data from undoped and Co doped BaFe2As2. Overlapping, rigid parabolic electron and hole bands are considered as a model of the electronic structure of the FeAs-based semimetals. The model has only three parameters: the electron and hole effective masses and the position of the valence band maximum with respect to the conduction band minimum. The model is able to reproduce in a semiquantitative fashion the magnitude and temperature dependence of many of the normal state magnetic and transport data from the FeAs-type materials, including the ubiquitous increase in the magnetic susceptibility with increasing temperature.

cond-mat.supr-con↗

Suppression of spin density wave by isoelectronic substitution in PrFe(1-x)Ru(x)AsO

We have studied the effects of the isoelectronic substitution of Ru for Fe in polycrystalline samples of the spin density wave (SDW) material PrFeAsO. Crystal structures from powder x-ray diffraction at room temperature and transport properties from 2-300 K are reported. The SDW is completely suppressed upon Ru substitution. The distortion of the tetrahedral coordination environment of the transition metal site increases as the Ru concentration increases, which may be related to the absence of superconductivity above 2 K. Band structure calculations show that the larger size of Ru 4$d$ orbitals is primarily responsible for the suppression of magnetism as Ru is substituted into the Fe layer. The experimental results indicate that long-ranged magnetic order of Pr moments is suppressed at Ru concentrations as low as 10%.

cond-mat.supr-con↗

Hole-doped BaFe2-xCrxAs2 Crystals: A Case of Non-superconductivity

We investigate the physical properties and electronic structure upon Cr-doping in the iron arsenide layers of BaFe2As2. This form of hole-doping leads to suppression of the magnetic/structural phase transition in BaFe2-xCrxAs2 for x > 0, but does not lead to superconductivity. For various x values, temperature dependence of the resistivity, specific heat, magnetic susceptibility, Hall coefficient, and single crystal x-ray diffraction data are presented. The materials show signatures of approaching a ferromagnetic state with x, including a metamagnetic transition for x as little as 0.36, an enhanced magnetic susceptibility, and a large Sommerfeld coefficient. Such results reflect renormalization due to spin fluctuations and they are supported by density functional calculations at x = 1. Calculations show a strong interplay between magnetic ordering and chemical ordering of Fe and Cr, with a ferromagnetic ground state. This ferromagnetic ground state is explained in terms of the electronic structure. The resulting phase diagram is suggestive that superconductivity does not derive simply from the suppression of the structural/magnetic transitions.

cond-mat.supr-con↗

BaT2As2 Single Crystals (T = Fe, Co, Ni) and Superconductivity upon Co-doping

The crystal structure and physical properties of BaFe2As2, BaCo2As2, and BaNi2As2 single crystals are surveyed. BaFe2As2 gives a magnetic and structural transition at TN = 132(1) K, BaCo2As2 is a paramagnetic metal, while BaNi2As2 has a structural phase transition at T0 = 131 K, followed by superconductivity below Tc = 0.69 K. The bulk superconductivity in Co-doped BaFe2As2 below Tc = 22 K is demonstrated by resistivity, magnetic susceptibility, and specific heat data. In contrast to the cuprates, the Fe-based system appears to tolerate considerable disorder in the transition metal layers. First principles calculations for BaFe1.84Co0.16As2 indicate the inter-band scattering due to Co is weak.

cond-mat.supr-con↗

Influence of the rare-earth element on the effects of the structural and magnetic phase transitions in CeFeAsO, PrFeAsO, and NdFeAsO

We present results of transport and magnetic properties and heat capacity measurements on polycrystalline CeFeAsO, PrFeAsO, and NdFeAsO. These materials undergo structural phase transitions, spin density wave-like magnetic ordering of small moments on iron, and antiferromagnetic ordering of rare earth moments. The temperature dependence of the electrical resistivity, Seebeck coefficient, thermal conductivity, Hall coefficient, and magnetoresistance are reported. The magnetic behavior of the materials have been investigated using Mossbauer spectroscopy and magnetization measurements. Transport and magnetic properties are affected strongly by the structural and magnetic transitions, suggesting significant changes in the band structure and/or carrier mobilities occur, and phonon-phonon scattering is reduced upon transformation to the low temperature structure. Results are compared to recent reports for LaFeAsO, and systematic variations in properties as the identity of Ln is changed are observed and discussed. As Ln progresses across the rare-earth series from La to Nd, an increase in the hole contributions to Seebeck coefficient, and increases in magnetoresistance and the Hall coefficient are observed in the low temperature phase. Analysis of hyperfine fields at the iron nuclei determined from Mossbauer spectra indicates that the moment on Fe in the orthorhombic phase is nearly independent of the identity of Ln, in apparent contrast to reports of powder neutron diffraction refinements.

cond-mat.supr-con↗

Structure and Anisotropic Properties of BaFe2-xNixAs2 (x = 0, 1, 2) Single Crystals

The crystal structure, anisotropic electrical resistivity and magnetic susceptibility, as well as specific heat results from single crystals of BaFe2As2, BaNi2As2, and BaFeNiAs2 are surveyed. BaFe2As2 properties demonstrate the equivalence of C(T), Fisher's d(XT)/dT, and dp/dT results in determining the antiferromagnetic transition at TN = 132(1) K. BaNi2As2 shows a structural phase transition from a high-temperature tetragonal phase to a low-temperature triclinic (P-1) phase at T0 = 131 K.The superconducting critical temperature for BaNi2As2 is well below T0 and at Tc = 0.69 K. BaFeNiAs2 does not show any sign of superconductivity to 0.4 K and exhibits properties similar to BaCo2As2, a renormalized paramagnetic metal.

cond-mat.supr-con↗

Phase transitions in LaFeAsO: structural, magnetic, elastic, and transport properties, heat capacity and Mossbauer spectra

We present results from a detailed experimental investigation of LaFeAsO, the parent material in the series of "FeAs" based oxypnictide superconductors. Upon cooling this material undergoes a tetragonal-orthorhombic crystallographic phase transition at ~160 K followed closely by an antiferromagnetic ordering near 145 K. Analysis of these phase transitions using temperature dependent powder X-ray and neutron diffraction measurements is presented. A magnetic moment of ~0.35 Bohr magnetons per iron is derived from Mossbauer spectra in the low temperature phase. Evidence of the structural transition is observed at temperatures well above the structural transition (up to near 200 K) in the diffraction data as well as the polycrystalline elastic moduli probed by resonant ultrasound spectroscopy measurements. The effects of the two phase transitions on the transport properties (resistivity, thermal conductivity, Seebeck coefficient, Hall coefficient), heat capacity, and magnetization of LaFeAsO are also reported, including a dramatic increase in the magnitude of the Hall coefficient below 160 K. The results suggest that the structural distortion leads to a localization of carriers on Fe, producing small local magnetic moments which subsequently order antiferromagnetically upon further cooling. Evidence of strong electron-phonon interactions in the high-temperature tetragonal phase is also observed.

cond-mat.supr-con↗

Superconductivity at 22 K in Co-doped BaFe2As2 Crystals

Here we report bulk superconductivity in BaFe1.8Co0.2As2 single crystals below Tc = 22 K, as demonstrated by resistivity, magnetic susceptibility, and specific heat data. Hall data indicate that the dominant carriers are electrons, as expected from simple chemical reasoning. This is the first example of superconductivity induced by electron doping in this family of materials. In contrast to the cuprates, the BaFe2As2 system appears to tolerate considerable disorder in the FeAs planes. First principles calculations for BaFe1.8Co0.2As2 indicate the inter-band scattering due to Co is weak.

cond-mat.supr-con↗

Superconductivity in Co-doped LaFeAsO

Here we report the synthesis and basic characterization of LaFe1-xCoxAsO for several values of x. The parent phase LaFeAsO orders antiferromagnetically (TN ~ 145 K). Replacing Fe with Co is expected to both electron dope the system and introduce disorder in the FeAs layer. For x = 0.05 antiferromagnetic order is destroyed and superconductivity is observed at Tconset = 11.2 K. For x = 0.11 superconductivity is observed at Tc(onset) = 14.3 K, and for x = 0.15 Tc = 6.0 K. Superconductivity is not observed for x = 0.2 and 0.5, but for x = 1, the material appears to be ferromagnetic (Tc ~ 56 K) as judged by magnetization measurements. We conclude that Co is an effective dopant to induce superconductivity. Somewhat surprisingly, the system appears to tolerate considerable disorder in the FeAs planes.

cond-mat.supr-con↗

Electron Correlations in the Low Carrier Density LaFeAsO0.89F0.11 Superconductor (Tc = 28 K)

The crystal structure and numerous normal and superconducting state properties of layered tetragonal (P4/nmm) LaFeAsO, with F-doping of 11 %, are reported. Resistivity measurements give an onset transition temperature Tc = 28.2 K, and low field magnetic susceptibility data indicate bulk superconductivity. In applied magnetic field, analysis of the resistive transition results in a critical field Hc2 = 30 T and a coherence length 35 A. An upper limit for the electron carrier concentration of 1 x 10^21 cm-3 is inferred from Hall data just above Tc. Strong electron-electron correlations are suggested from temperature-dependent resistivity, Seebeck coefficient, and thermal conductivity data. Anomalies near Tc are observed in both Seebeck coefficient and thermal conductivity data.

cond-mat.supr-con↗

Orientation Dependence of the Anomalous Hall Resistivity in Single Crystals of Yb14MnSb11

The Hall resistivity, electrical resistivity and magnetization of single crystals of the tetragonal ferromagnet Yb14MnSb11 are reported as a function of the direction of the current, I, and magnetic field, H with respect to the principal crystallographic axes. With I along the unique c direction and H in the a-b plane, the anomalous Hall resistivity in the limit of zero applied field is negative for all temperatures T less than Tc= 53 K. In this direction, the anomalous Hall effect behaves in a manner similar to that observed in other ferromagnets such as Fe, Co, Mn5Ge3, and EuFe4Sb12. However, with I in the a-b plane and H along the c direction, the anomalous Hall behavior is completely different. The anomalous Hall resistivity data are positive for all T less than Tc and a similar analysis of these data fails. In this direction, the anomalous response is not a simple linear function of the magnetization order parameter, and for a fixed temperature (T less than Tc) does not depend on the magnitude of the magnetization perpendicular to the current in the a-b plane. That is, when the magnetization and applied field are rotated away from the c direction, the anomalous Hall resistivity does not change. In all other soft ferromagnets that we have examined (including La doped crystals of Yb14MnSb11, i.e. Yb13.3La0.7MnSb11) rotation of the magnetization and magnetic field by an angle theta away from a direction perpendicular to I results in a decrease in both the anomalous and normal portions of the Hall resistivity that approximately scales as cos(theta). We suggest that the unique response exhibited by Yb14MnSb11 is a direct reflection of the delicate balance between ferromagnetism and Kondo screening.

cond-mat.str-el↗

Anomalous Hall Effect in three ferromagnets: EuFe4Sb12, Yb14MnSb11, and Eu8Ga16Ge30

The Hall resistivity (Rho_xy), resistivity (Rho_xx), and magnetization of three metallic ferromagnets are investigated as a function of magnetic field and temperature. The three ferromagnets, EuFe4Sb12 (Tc = 84 K), Yb14MnSb11 (Tc = 53 K), and Eu8Ga16Ge30 (Tc = 36 K) are Zintl compounds with carrier concentrations between 1 x 10^21 cm^-3 and 3.5 x 10^21 cm^-3. The relative decrease in Rho_xx below Tc [Rho_xx(Tc)/Rho_xx(2 K)] is 28, 6.5, and 1.3 for EuFe4Sb12, Yb14MnSb11, and Eu8Ga16Ge30 respectively. The low carrier concentrations coupled with low magnetic anisotropies allow a relatively clean separation between the anomalous (Rho_'xy), and normal contributions to the measured Hall resistivity. For each compound the anomalous contribution in the zero field limit is fit to alpha Rho_xx + sigma_xy rho_xx^2 for temperatures T < Tc. The anomalous Hall conductivity, sigma_xy, is -220 +- 5 (Ohm^-1 cm^-1), -14.7 +- 1 (Ohm^-1 cm^-1), and 28 +- 3 (Ohm^-1 cm^-1) for EuFe4Sb12, Yb14MnSb11, and Eu8Ga16Ge30 respectively and is independent of temperature for T < Tc if the change in spontaneous magnetization (order parameter) with temperature is taken into account. These data are consistent with recent theories of the anomalous Hall effect that suggest that even for stochiometric ferromagnetic crystals, such as those studied in this article, the intrinsic Hall conductivity is finite at T = 0, and is a ground state property that can be calculated from the electronic structure.

cond-mat.other↗

Spin-Charge Coupling in lightly doped Nd$_{2-x}$Ce$_{x}$CuO$_4$

We use neutron scattering to study the influence of a magnetic field on spin structures of Nd$_2$CuO$_4$. On cooling from room temperature, Nd$_2$CuO$_4$ goes through a series of antiferromagnetic (AF) phase transitions with different noncollinear spin structures. While a c-axis aligned magnetic field does not alter the basic zero-field noncollinear spin structures, a field parallel to the CuO$_2$ plane can transform the noncollinear structure to a collinear one ("spin-flop" transition), induce magnetic disorder along the c-axis, and cause hysteresis in the AF phase transitions. By comparing these results directly to the magnetoresistance (MR) measurements of Nd$_{1.975}$Ce$_{0.025}$CuO$_4$, which has essentially the same AF structures as Nd$_2$CuO$_4$, we find that a magnetic-field-induced spin-flop transition, AF phase hysteresis, and spin c-axis disorder all affect the transport properties of the material. Our results thus provide direct evidence for the existence of a strong spin-charge coupling in electron-doped copper oxides.

cond-mat.supr-con↗