arXiv subjects

P. Y. Zavalij

Publications and source records attributed to P. Y. Zavalij.

10 recordsLinked to original sources

arXiv2025

Measurements and scaling of X-ray total scattering from single crystals

We present a measurement protocol and a data reduction workflow for obtaining single-crystal X-ray total-scattering datasets that capture both Bragg-peak and diffuse scattering intensities on an absolute (electrons2/atom) scale. We further demonstrate that the intensity scale factor derived from crystallographic refinements using Bragg peaks is in close agreement with that obtained by matching the scattering function, computed via spherical integration of the 3D total scattering signal, to the theoretical coherent baseline, calculated as the spherical average of the Debye-Waller factor. The latter approach can be applied to diffuse scattering without including Bragg peaks. Our results set the ground for structural refinements using large atomic configurations while simultaneously fitting Bragg intensities and diffuse scattering from a single crystal. Moreover, with the convergence between the two scaling methods, the Bragg and diffuse components can be obtained from the same total-scattering dataset, as achieved in this work, or measured independently.

cond-mat.mtrl-sci↗

arXiv2022

Anomalous symmetry breaking in Weyl semimetal CeAlGe

CeAlGe, a proposed type-II Weyl semimetal, orders antiferromagnetically below 5 K. At 2 K, spin-flop and a spin-flip transitions to less than 1 $μ_B$/Ce are observed in the $M(H)$ data below 30 kOe, ($\bf{H}\|\bf{a}$ and $\bf{b}$, and 4.3 kOe, $\bf{H}\|\langle110\rangle$, respectively, indicating a four-fold symmetry of the $M(H)$ data along the principal directions in the tetragonal $\it{ab}$ plane with $\langle110\rangle$ set of easy directions. However, anomalously robust and complex twofold symmetry is observed in the angular dependence of resistivity and magnetic torque data in the magnetically ordered state once the field is swept in the $\it{ab}$ plane. This twofold symmetry is independent of temperature and field hystereses and suggests a magnetic phase transition that separates two different magnetic structures in the $\it{ab}$ plane. The boundary of this magnetic phase transition and possibly the type of low-field magnetic structure can be tuned by an Al deficiency.

cond-mat.str-el↗

arXiv2021

Physical properties and electronic structure of single-crystal KCo$_2$As$_2$

We present a method for producing high quality KCo2As2 crystals, stable in air and suitable for a variety of measurements. X-ray diffraction, magnetic susceptibility, electrical transport and heat capacity measurements confirm the high quality and an absence of long range magnetic order down to at least 2 K. Residual resistivity values approaching 0.25 $μΩ$~cm are representative of the high quality and low impurity content, and a Sommerfeld coefficient $γ$ = 7.3 mJ/mol K$^2$ signifies weaker correlations than the Fe-based counterparts. Together with Hall effect measurements, angle-resolved photoemission experiments reveal a Fermi surface consisting of electron pockets at the center and corner of the Brillouin zone, in line with theoretical predictions and in contrast to the mixed carrier types of other pnictides with the ThCr2Si2 structure. A large, linear magnetoresistance of 200\% at 14~T, together with an observed linear and hyperbolic, rather than parabolic, band dispersions are unusual characteristics of this metallic compound and may indicate more complex underlying behavior.

cond-mat.str-el↗

arXiv2020

Quantum-critical scale invariance in a transition metal alloy

Quantum-mechanical fluctuations between competing phases at $T=0$ induce exotic finite-temperature collective excitations that are not described by the standard Landau Fermi liquid framework. These excitations exhibit anomalous temperature dependences, or non-Fermi liquid behavior, in the transport and thermodynamic properties in the vicinity of a quantum critical point, and are often intimately linked to the appearance of unconventional Cooper pairing as observed in strongly correlated systems including the high-$T_c$ cuprate and iron pnictide superconductors. The presence of superconductivity, however, precludes direct access to the quantum critical point, and makes it difficult to assess the role of quantum-critical fluctuations in shaping anomalous finite-temperature physical properties. Here we report temperature-field scale invariance of non-Fermi liquid thermodynamic, transport, and Hall quantities in a non-superconducting iron-pnictide, Ba(Fe$_{1/3}$Co$_{1/3}$Ni$_{1/3}$)$_{2}$As$_{2}$, indicative of quantum criticality at zero temperature and zero applied magnetic field. Beyond a linear in temperature resistivity, the hallmark signature of strong quasiparticle scattering, we find the scattering rate that obeys a universal scaling relation between temperature and applied magnetic fields down to the lowest energy scales. Together with the dominance of hole-like carriers close to the zero-temperature and zero-field limits, the scale invariance, isotropic field response, and lack of applied pressure sensitivity suggests a unique quantum critical system that does not drive a pairing instability.

cond-mat.str-el↗

arXiv2019

Tuning the Hysteresis of a Metal-Insulator Transition via Lattice Compatibility

Structural phase transitions serve as the basis for many functional applications including shape memory alloys (SMAs), switches based on metal-insulator transitions (MITs), etc. In such materials, lattice incompatibility between phases often results in a thermal hysteresis, which is intimately tied to degradation of reversibility of the transformation. The non-linear theory of martensite suggests that the hysteresis of a martensitic phase transformation is solely determined by the lattice constants, and the conditions proposed for geometrical compatibility have been successfully applied to minimizing the hysteresis in SMAs. In this work, we apply the non-linear theory to a strongly correlated oxide system (W doped VO2), and show that the hysteresis of the MIT in the system can be directly tuned by adjusting the lattice constants of the phases. The results underscore the profound influence structural compatibility has on intrinsic electronic properties, and indicate that the theory provides a universal guidance for optimizing phase transforming materials.

cond-mat.mtrl-sci↗

arXiv2018

Single crystal investigation of proposed type-II Weyl semimetal CeAlGe

We present details of materials synthesis, crystal structure, and anisotropic magnetic properties of single crystals of CeAlGe, a proposed type-II Weyl semimetal. Single-crystal x-ray diffraction confirms that CeAlGe forms in noncentrosymmetric I4$_1$md space group, in line with predictions of non-trivial topology. Magnetization, specific heat and electrical transport measurements were used to confirm antiferromagnetic order below 5 K, with an estimated magnon excitation gap of $Δ$ = 9.11 K from heat capacity and hole-like carrier density of 1.44 $\times$ 10$^{20}$ cm$^{-3}$ from Hall effect measurements. The easy magnetic axis is along the [100] crystallographic direction, indicating that the moment lies in the tetragonal $\it{ab}$-plane below 7 K. A spin-flop transition to less than 1 $μ_B$/Ce is observed to occur below 30 kOe at 1.8 K in the $M(H)$ ($\bf{H}\|\bf{a}$) data. Small magnetic fields of 3 kOe and 30 kOe are sufficient to suppress magnetic order when applied along the $\it{a}$- and $\it{c}$-axes, respectively, resulting in a complex $\it{T-H}$ phase diagram for $\bf{H}\|\bf{a}$ and a simpler one for $\bf{H}\|\bf{c}$.

cond-mat.str-el↗

arXiv2015

Tunable electronic anisotropy in single-crystal A2Cr3As3 (A = K, Rb) quasi-one-dimensional superconductors

Single crystals of A2Cr3As3 (A = K, Rb) were successfully grown using a self-flux method and studied via structural, transport and thermodynamic measurement techniques. The superconducting state properties between the two species are similar, with critical temperatures of 6.1 K and 4.8 K in K2Cr3As3 and Rb2Cr3As3, respectively. However, the emergence of a strong normal state electronic anisotropy in Rb2Cr3As3 suggests a unique electronic tuning parameter is coupled to the inter-chain spacing in the A2Cr3As3 structure, which increases with alkali metal ionic size while the one-dimensional [(Cr3As3)^{2-}]_{\infty} chain structure itself remains essentially unchanged. Together with dramatic enhancements in both conductivity and magnetoresistance (MR), the appearance of a strong anisotropy in the MR of Rb2Cr3As3 is consistent with the proposed quasi-one-dimensional character of band structure and its evolution with alkali metal species in this new family of superconductors.

cond-mat.supr-con↗

arXiv2012

Tuning magnetism in FeAs-based materials via tetrahedral structure

Resistivity, magnetic susceptibility, neutron scattering and x-ray crystallography measurements were used to study the evolution of magnetic order and crystallographic structure in single-crystal samples of the Ba1-xSrxFe2As2 and Sr1-yCayFe2As2 series. A non-monotonic dependence of the magnetic ordering temperature T0 on chemical pressure is compared to the progression of the antiferromagnetic staggered moment, characteristics of the ordering transition and structural parameters to reveal a distinct relationship between the magnetic energy scale and the tetrahedral bond angle, even far above T0. In Sr1-yCayFe2As2, an abrupt drop in T0 precisely at the Ca concentration where the tetrahedral structure approaches the ideal geometry indicates a strong coupling between the orbital bonding structure and the stabilization of magnetic order, providing strong constraints on the nature of magnetism in the iron-arsenide superconducting parent compounds.

cond-mat.supr-con↗

arXiv2011

Structural collapse and superconductivity in rare earth-doped CaFe2As2

Aliovalent rare earth substitution into the alkaline earth site of CaFe2As2 single-crystals is used to fine-tune structural, magnetic and electronic properties of this iron-based superconducting system. Neutron and single crystal x-ray scattering experiments indicate that an isostructural collapse of the tetragonal unit cell can be controllably induced at ambient pressures by choice of substituent ion size. This instability is driven by the interlayer As-As anion separation, resulting in an unprecedented thermal expansion coefficient of $180\times 10^{-6}$ K$^{-1}$. Electrical transport and magnetic susceptibility measurements reveal abrupt changes in the physical properties through the collapse as a function of temperature, including a reconstruction of the electronic structure. Superconductivity with onset transition temperatures as high as 47 K is stabilized by the suppression of antiferromagnetic order via chemical pressure, electron doping or a combination of both. Extensive investigations are performed to understand the observations of partial volume-fraction diamagnetic screening, ruling out extrinsic sources such as strain mechanisms, surface states or foreign phases as the cause of this superconducting phase that appears to be stable in both collapsed and uncollapsed structures.

cond-mat.supr-con↗

arXiv2010

Superconductivity at 23 K in Pt doped BaFe2As2 single crystals

We report superconductivity in single crystals of the new iron-pnictide system BaFe1.9Pt0.1As2 grown by a self-flux solution method and characterized via x-ray, transport, magnetic and thermodynamic measurements. The magnetic ordering associated with a structural transition at 140 K present in BaFe2As2 is completely suppressed by substitution of 5% Fe with Pt and superconductivity is induced at a critical temperature Tc=23 K. Full diamagnetic screening in the magnetic susceptibility and a jump in the specific heat at Tc confirm the bulk nature of the superconducting phase. All properties of the superconducting state including transition temperature Tc, the lower critical field Hc1=200 mT, upper critical field Hc2~65 T, and the slope dHc2/dT are comparable in value to the those found in other transition-metal-substituted BaFe2As2 series, indicating the robust nature of superconductivity induced by substitution of Group VIII elements.

cond-mat.supr-con↗