16 research outputs found

    High order magnon bound states in the quasi-one-dimensional antiferromagnet α\alpha-NaMnO2_2

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    Here we report on the formation of two and three magnon bound states in the quasi-one-dimensional antiferromagnet α\alpha-NaMnO2_2, where the single-ion, uniaxial anisotropy inherent to the Mn3+^{3+} ions in this material provides a binding mechanism capable of stabilizing higher order magnon bound states. While such states have long remained elusive in studies of antiferromagnetic chains, neutron scattering data presented here demonstrate that higher order n>2n>2 composite magnons exist, and, specifically, that a weak three-magnon bound state is detected below the antiferromagnetic ordering transition of NaMnO2_2. We corroborate our findings with exact numerical simulations of a one-dimensional Heisenberg chain with easy-axis anisotropy using matrix-product state techniques, finding a good quantitative agreement with the experiment. These results establish α\alpha-NaMnO2_2 as a unique platform for exploring the dynamics of composite magnon states inherent to a classical antiferromagnetic spin chain with Ising-like single ion anisotropy.Comment: 5 pages, 4 figure

    Quantitative investigation of the short-range magnetic correlations in candidate quantum spin liquid NaYbO2_2

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    We present a neutron diffraction study of NaYbO2_2, a candidate quantum spin liquid compound hosting a geometrically frustrated triangular lattice of magnetic Yb3+^{3+} ions. We observe diffuse magnetic scattering that persists to at least 20 K, demonstrating the presence of short-range magnetic correlations in this system up to a relatively high energy scale. Using reverse Monte Carlo and magnetic pair distribution function analysis, we confirm the predominant antiferromagnetic nature of these correlations and show that the diffuse scattering data can be well described by noninteracting layers of XY spins on the triangular lattice. We rule out Ising spins and short-range-ordered stripe or 120∘^{\circ} phases as candidate ground states of NaYbO2_2. These results are consistent with a possible QSL ground state in NaYbO2_2 and showcase the benefit of combined reciprocal- and real-space analysis of materials with short-range magnetic correlations

    Defect Tolerance to Intolerance in the Vacancy-Ordered Double Perovskite Semiconductors Cs<sub>2</sub>SnI<sub>6</sub> and Cs<sub>2</sub>TeI<sub>6</sub>

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    Vacancy-ordered double perovskites of the general formula <i>A</i><sub>2</sub><i>BX</i><sub>6</sub> are a family of perovskite derivatives composed of a face-centered lattice of nearly isolated [<i>BX</i><sub>6</sub>] units with <i>A</i>-site cations occupying the cuboctahedral voids. Despite the presence of isolated octahedral units, the close-packed iodide lattice provides significant electronic dispersion, such that Cs<sub>2</sub>SnI<sub>6</sub> has recently been explored for applications in photovoltaic devices. To elucidate the structure–property relationships of these materials, we have synthesized solid-solution Cs<sub>2</sub>Sn<sub>1–<i>x</i></sub>Te<sub><i>x</i></sub>I<sub>6</sub>. However, even though tellurium substitution increases electronic dispersion via closer I–I contact distances, the substitution experimentally yields insulating behavior from a significant decrease in carrier concentration and mobility. Density functional calculations of native defects in Cs<sub>2</sub>SnI<sub>6</sub> reveal that iodine vacancies exhibit a low enthalpy of formation, and that the defect energy level is a shallow donor to the conduction band rendering the material tolerant to these defect states. The increased covalency of Te–I bonding renders the formation of iodine vacancy states unfavorable and is responsible for the reduction in conductivity upon Te substitution. Additionally, Cs<sub>2</sub>TeI<sub>6</sub> is intolerant to the formation of these defects, because the defect level occurs deep within the band gap and thus localizes potential mobile charge carriers. In these vacancy-ordered double perovskites, the close-packed lattice of iodine provides significant electronic dispersion, while the interaction of the <i>B</i>- and <i>X</i>-site ions dictates the properties as they pertain to electronic structure and defect tolerance. This simplified perspective based on extensive experimental and theoretical analysis provides a platform from which to understand structure–property relationships in functional perovskite halide
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