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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 775 records · Page 43
All sourcesNASA NTRSDOE OSTI
DOE OSTI2021

Correlation between antiferromagnetic and Mott states in spin orbit coupled Sr 2 Ir O 4 : A study of Sr 2 Ir 1 – x M x O 4 ( M = Fe or Co)

Sr 2 IrO 4 is an archetypal spin-orbit-coupled Mott insulator with an antiferromagnetic state below 240 K. Here we report results of our study on single crystals of Sr 2 Ir 1–x Fe x O 4 (0 ≤ x < 0.32) and Sr 2 Ir 1–x Co x O 4 (0 ≤ x < 0.22). Fe doping retains the antiferromagnetic state but simultaneously precipitates an emergent metallic state whereas Co doping causes a rapid collapse of both the antiferromagnetic and Mott states, giving rise to a confined metallic state featuring a pronounced linearity of the basal-plane resistivity up to 700 K. The results indicate tetravalent Fe 4+ (3d 4 ) ions in the intermediate spin state with S = 1 and Co 4+ (3d 5 ) ions in the high spin state with S = 5/2 substituting for Ir 4+ (5d 5 ) ions in Sr 2 IrO 4 , respectively. The effective magnetic moment closely tracks the Néel temperature as doping increases, suggesting that the spin state of the dopant predominately determines the magnetic properties in doped Sr 2 IrO 4 . Furthermore, all relevant properties including charge-carrier density (e.g., 10 28 /m 3 ), Sommerfeld coefficient (e.g., 19 mJ / mole K 2 ), and Wilson ratio (e.g., 2.6) consistently demonstrate an emergent metallic state that is both robust and highly correlated in the two systems, arising from the percolation of bound states and the weakening of structural distortions. Furthermore, this study strongly indicates that the antiferromagnetic and Mott states are correlated in an unconventional manner in Sr 2 IrO 4 .

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2021

Nanoscale heterogeneity induced by nonmagnetic Zn dopants in the quantum critical metal CeCoIn 5 : 115 In NQR/NMR and 59 Co NMR study

We report antiferromagnetism in a prototypical quantum critical metal CeCoIn 5 is known to be induced by slight substitutions of nonmagnetic Zn atoms for In. In nominally 7% Zn-substituted CeCoIn 5 , an antiferromagnetic (AFM) state coexists with heavy fermion superconductivity. Heterogeneity of the electronic states is investigated in Zn-doped CeCoIn 5 by means of nuclear quadrupole and magnetic resonances (NQR and NMR). Site-dependent NQR relaxation rates 1/T 1 indicate that the AFM state is locally nucleated around Zn substituents in the matrix of a heavy fermion state, and percolates through the bulk at the AFM transition temperature T N . At lower temperatures, an anisotropic superconducting (SC) gap below the SC transition temperature Tc, and the SC state permeates through the AFM regions via a SC proximity effect. Applying an external magnetic field induces a spin-flop transition near 5T, reducing the volume of the AFM regions. Consequently, a short-ranged inhomogeneous AFM state survives and coexists with a paramagnetic Fermi liquid state at high fields.

36 MATERIALS SCIENCE↗
DOE OSTI2022

Entanglement phase transitions in random stabilizer tensor networks

Here we explore a class of random tensor network models with “stabilizer” local tensors which we name random stabilizer tensor networks (RSTNs). For RSTNs defined on a two-dimensional square lattice, we perform extensive numerical studies of entanglement phase transitions between volume-law and area-law entangled phases of the one-dimensional boundary states. These transitions occur when either (a) the bond dimension D of the constituent tensors is varied or (b) the tensor network is subject to random breaking of bulk bonds, implemented by forced measurements. In the absence of broken bonds, we find that the RSTN supports a volume-law entangled boundary state with bond dimension D ≥ 3 where D is a prime number, and an area-law entangled boundary state for D = 2. Upon breaking bonds at random in the bulk with probability p, there exists a critical measurement rate p c for each D ≥ 3 above which the boundary state becomes area-law entangled. To explore the conformal invariance at these entanglement transitions for different prime D, we consider tensor networks on a finite rectangular geometry with a variety of boundary conditions, and extract universal operator scaling dimensions via extensive numerical calculations of the entanglement entropy, mutual information, and mutual negativity at their respective critical points. Our results at large D approach known universal data of percolation conformal field theory, while showing clear discrepancies at smaller D, suggesting a distinct entanglement transition universality class for each prime D. We further study universal entanglement properties in the volume-law phase and demonstrate quantitative agreement with the recently proposed description in terms of a directed polymer in a random environment.

36 MATERIALS SCIENCE↗
DOE OSTI2024

Random fields from quenched disorder in an archetype for correlated electrons: The parallel spin stripe phase of La 1.6 – x Nd 0.4 Sr x CuO 4 at the 1/8 anomaly

The parallel stripe phase is remarkable both in its own right, and in relation to the other phases with which it coexists. Its inhomogeneous nature makes such states susceptible to random fields from quenched magnetic vacancies. Here we argue this is the case by introducing low concentrations of nonmagnetic Zn impurities (0%–10%) into La 1.6–x ⁢Nd 0.4⁢ Sr x ⁢CuO 4 (Nd-LSCO) with x=0.125 in single-crystal form, well below the percolation threshold of ~41% for a two-dimensional square lattice. Elastic neutron scattering measurements on these crystals show clear magnetic quasi-Bragg peaks at all Zn dopings. While all the Zn-doped crystals display order parameters that merge into each other and the background at ~68 K, the temperature dependence of the order parameter as a function of Zn concentration is drastically different. This result is consistent with meandering charge stripes within the parallel stripe phase, which are pinned in the presence of quenched magnetic vacancies. In turn it implies vacancies that preferentially occupy sites within the charge stripes, and hence that can be very effective at disrupting superconductivity in Nd-LSCO (x=0.125), and, by extension, in all systems exhibiting parallel stripes.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2024

Hopping crossover and high-temperature superspin glass behavior in Ni films deposited on MoS 2

Realizing the potential of MoS 2 and other two-dimensional semiconductors in spintronic devices requires a fundamental understanding of their interaction with ferromagnetic metals. We have investigated the transport and magnetic properties of thin Ni films grown on single-crystal MoS 2 substrates. The Ni is found to have a granular morphology with an average grain size of approximately 2 nm. Like previously investigated granular Ni/insulator composites below the percolation threshold, transport is found to proceed via hopping. However, our Ni/MoS 2 sample exhibits a dual crossover: activated hopping to 𝑇−1/2 variable-range hopping at a higher temperature and then a transition to power-law behavior at a lower temperature. The magnetoresistance was used as a novel probe for uncovering superspin-glass-like behavior above room temperature in the Ni/MoS 2 nanostructure, which also exhibits a collective ferromagnetic state at very low temperatures, reminiscent of superferromagnetism.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2013

Inhomogeneous magnetism in the doped kagome lattice of LaCuO2.66

The hole-doped kagome lattice of Cu2+ ions in LaCuO2.66 was investigated by nuclear quadrupole resonance (NQR), electron spin resonance (ESR), electrical resistivity, bulk magnetization and specific heat measurements. For temperatures above 180 K, the spin and charge properties show an activated behavior suggestive of a narrow-gap semiconductor. At lower temperatures, the results indicate an insulating ground state which may or may not be charge ordered. While the frustrated spins in remaining patches of the original kagome lattice might not be directly detected here, the observation of coexisting non-magnetic sites, free spins and frozen moments reveals an intrinsically inhomogeneous magnetism. Numerical simulations of a 1/3-diluted kagome lattice rationalize this magnetic state in terms of a heterogeneous distribution of cluster sizes and morphologies near the site-percolation threshold.

Julien, M. -H.↗
DOE OSTI2015

Entanglement spectrum of a random partition: Connection with the localization transition

We study the entanglement spectrum of a translationally invariant lattice system under a random partition, implemented by choosing each site to be in one subsystem with probability p ϵ[0,1]. We apply this random partitioning to a translationally invariant (i.e., clean) topological state, and argue on general grounds that the corresponding entanglement spectrum captures the universal behavior about its disorder-driven transition to a trivial localized phase. Specifically, as a function of the partitioning probability p , the entanglement Hamiltonian H A must go through a topological phase transition driven by the percolation of a random network of edge states. For example, we analytically derive the entanglement Hamiltonian for a one-dimensional topological superconductor under a random partition, and demonstrate that its phase diagram includes transitions between Griffiths phases. We discuss potential advantages of studying disorder-driven topological phase transitions via the entanglement spectra of random partitions.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2015

Two-dimensional superconductor-insulator quantum phase transitions in an electron-doped cuprate

Here, we use an ionic liquid-assisted electric-field effect to tune the carrier density in an electron-doped cuprate ultrathin film and cause a two-dimensional superconductor-insulator transition (SIT). The low upper critical field in this system allows us to perform magnetic-field (B)-induced SIT in the liquid-gated superconducting film. Finite-size scaling analysis indicates that SITs induced both by electric and by magnetic fields are quantum phase transitions and the transitions are governed by percolation effects-quantum mechanical in the former and classical in the latter cases. Compared to the hole-doped cuprates, the SITs in the electron-doped system occur at critical sheet resistances (R c ) much lower than the pair quantum resistance R Q = h/(2e) 2 = 6.45 kΩ, suggesting the possible existence of fermionic excitations at finite temperatures at the insulating phase near the SITs.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2015

Role of magnetism in superconductivity of BaFe 2 As 2 : Study of 5d Au-doped crystals

We investigate properties of BaFe 2 As 2 (122) single crystals upon gold doping, which is the transition metal with the highest atomic weight. The Au substitution into the FeAs-planes of 122 crystal structure (Au-122) is only possible up to a small amount of ~3%. We find that 5d is more effective in reducing magnetism in 122 than its counter 3d Cu, and this relates to superconductivity. We provide evidence of short-range magnetic fluctuations and local lattice inhomogeneities that may prevent strong percolative superconductivity in Ba(Fe 1-x Au x )2As 2 .

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2016

Unusual Kondo-hole effect and crystal-field frustration in Nd-doped CeRhIn 5

In this research, we investigate single crystals of Ce 1₋x Nd x RhIn 5 by means of x-ray-diffraction, microprobe, magnetic susceptibility, heat capacity, and electrical resistivity measurements. Our data reveal that the antiferromagnetic transition of CeRhIn 5 , at T$Ce\atop{N}$=3.8 K, is linearly suppressed with x Nd . We associate this effect with the presence of a “Kondo hole” created by Nd substitution. The extrapolation of T$Ce\atop{N}$ to zero temperature, however, occurs at x c ~0.3, which is below the two-dimensional percolation limit found in Ce 1₋x La x RhIn 5 . This result strongly suggests the presence of a crystal-field induced magnetic frustration. Near x Nd ~0.2, the Ising antiferromagnetic order from Nd 3+ ions is stabilized and T$Nd\atop{N}$ increases up to 11 K in NdRhIn 5 . Finally, our results shed light on the effects of magnetic doping in heavy-fermion antiferromagnets and stimulate the study of such systems under applied pressure.

36 MATERIALS SCIENCE↗
DOE OSTI2016

Correlated impurities and intrinsic spin-liquid physics in the kagome material herbertsmithite

Low energy inelastic neutron scattering on single crystals of the kagome spin-liquid compound ZnCu 3 (OD) 6 Cl 2 (herbertsmithite) reveals in this paper antiferromagnetic correlations between impurity spins for energy transfers h(with stroke)ω < 0.8 meV (~ J/20). The momentum dependence differs significantly from higher energy scattering which arises from the intrinsic kagome spins. The low energy fluctuations are characterized by diffuse scattering near wave vectors (100) and (00 3/2), which is consistent with antiferromagnetic correlations between pairs of nearest-neighbor Cu impurities on adjacent triangular (Zn) interlayers. The corresponding impurity lattice resembles a simple cubic lattice in the dilute limit below the percolation threshold. Such an impurity model can describe prior neutron, NMR, and specific heat data. The low energy neutron data are consistent with the presence of a small spin gap (Δ ~ 0.7 meV) in the kagome layers, similar to that recently observed by NMR. Finally, the ability to distinguish the scattering due to Cu impurities from that of the planar kagome Cu spins provides an important avenue for probing intrinsic spin-liquid physics.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2016

Disorder effects on the band structure of ZnGeN 2 : Role of exchange defects

The role of exchange defects on the band structure of ZnGeN 2 is investigated. Exchange defects are defined through the exchange of cations Zn and Ge starting from the ideal Pna2 1 crystal structure, which obeys the local octet rule. Each such exchange creates several nitrogen-centered tetrahedra which violate the local octet rule, although overall charge neutrality is preserved. We study several distributions of exchange defects, some with all antisites making up the exchange defect close to each other and with increasing numbers of exchange defects, and others where the two types of antisites Zn Ge and Ge Zn are kept separated from each other. We also compare the results for these models with a fully random distribution of Zn and Ge on the cation sites. We show that for a single-nearest-neighbor exchange defect, the band gap is narrowed by about 0.5 eV due to two effects: (1) the Zn Ge antisites form filled acceptor states just above and merging with the valence-band maximum (VBM) of perfect crystal ZnGeN 2 and (2) the Ge Zn antisites form a resonance in the conduction band which lowers the conduction-band minimum (CBM). When more exchange defects are created, these acceptor states broaden into bands which can lower the gap further. When tetrahedra occur surrounded completely by four Zn atoms, states even deeper in the gap are found localized all near these tetrahedra, forming a separate intermediate band. Finally, for phase-segregated Zn Ge and Ge Zn , the gap is significantly more reduced, but no separate band is found to occur. The Zn Ge acceptorlike states now form a percolating defect band which is significantly wider and hence reaches deeper into the gap. In all cases, the wave functions near the top of the new VBM remain, to some extent, localized near the Zn Ge sites. For a fully random case, the gap is even more severely reduced by almost 3 eV. The total energy of the system increases with the number of octet-rule-violating tetrahedra and the energy cost per exchange defect of order 2 eV is quite high.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2017

Localization landscape theory of disorder in semiconductors. III. Application to carrier transport and recombination in light emitting diodes

In this paper we introduce a novel method to account for quantum disorder effects into the classical drift-diffusion model of semiconductor transport through the localization landscape theory. Quantum confinement and quantum tunneling in the disordered system change dramatically the energy barriers acting on the perpendicular transport of heterostructures. In addition, they lead to percolative transport through paths of minimal energy in the two-dimensional (2D) landscape of disordered energies of multiple 2D quantum wells. This model solves the carrier dynamics with quantum effects self-consistently and provides a computationally much faster solver when compared with the Schrödinger equation resolution. The theory also provides a good approximation to the density of states for the disordered system over the full range of energies required to account for transport at room temperature. The current-voltage characteristics modeled by three-dimensional simulation of a full nitride-based light emitting diode (LED) structure with compositional material fluctuations closely match the experimental behavior of high-quality blue LEDs. The model allows also a fine analysis of the quantum effects involved in carrier transport through such complex heterostructures. Finally, details of carrier population and recombination in the different quantum wells are given.

36 MATERIALS SCIENCE↗
DOE OSTI2017

Superconductor to weak-insulator transitions in disordered tantalum nitride films

Here, we study the two-dimensional superconductor-insulator transition (SIT) in thin films of tantalum nitride. At zero magnetic field, films can be disorder-tuned across the SIT by adjusting thickness and film stoichiometry; insulating films exhibit classical hopping transport. Superconducting films exhibit a magnetic-field-tuned SIT, whose insulating ground state at high field appears to be a quantum-corrected metal. Scaling behavior at the field-tuned SIT shows classical percolation critical exponents zν ≈ 1.3, with a corresponding critical field H c << H c2 , the upper critical field. The Hall effect exhibits a crossing point near H c , but with a nonuniversal critical value ρ c xy comparable to the normal-state Hall resistivity. We propose that high-carrier-density metals will always exhibit this pattern of behavior at the boundary between superconducting and (trivially) insulating ground states.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2018

Quantum phase transition of chiral Majorana fermions in the presence of disorder

Here, we study the quantum phase transitions of a disordered two-dimensional quantum anomalous Hall insulator with s-wave superconducting proximity, which are governed by the percolation theory of chiral Majorana fermions. Based on symmetry arguments and a renormalization-group analysis, we show there are generically two phase transitions from Bogoliubov–de Gennes Chern number N=0 to N=1(p+ip chiral topological superconductor) and then to N=2, in agreement with the conclusion from the band theory without disorders. Further, we discuss the critical scaling behavior of the e 2 /2h conductance half plateau induced by the N=1 chiral topological superconductor recently observed in the experiment. In particular, we compare the critical behavior of the half plateau induced by the topological superconductor with that predicted recently by alternative explanations of the half plateau and show that they can be distinguished in experiments.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗