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Register a new userUnified quantitative model for magnetic and electronic spectra of the undoped cuprates
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Added by
Bastien Dalla Piazza
Publication date
2011
fields
Physics
and research's language is
English
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Using low-energy projection of the one-band t-t-t-Hubbard model we derive an effective spin-Hamiltonian and its spin-wave expansion to order 1/S. We fit the spin-wave dispersion of several parent compounds to the high-temperature superconducting cuprates: La2CuO4, Sr2CuO2Cl2 and Bi2Sr2YCu2O8. Our accurate quantitative determination of the one-band Hubbard model parameters allows prediction and comparison to experimental results of measurable quantities such as staggered moment, double occupancy density, spin-wave velocity and bimagnon excitation spectrum and density of states, which is discussed in relation to K-edge RIXS and Raman experiments.
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We investigate the magnetic excitations in view of the recent reports suggesting that the spin-wave energy may exhibit a significant dependence on the in-plane strain of a thin film of La$_2$CuO$_4$. The nature of dependence, as we find, can be explained naturally within a two-orbital model based on the $d_{x^2-y^2}$ and $d_{3z^2-r^2}$ orbitals. In particular, as the orbital-splitting energy between the $d_{x^2-y^2}$ and $d_{3z^2-r^2}$ orbitals increases with compressive strain, the zone-boundary spin-wave energy hardens. However, the hardening persists only until the orbital splitting reaches $sim$ 2eV, beyond which there is no significant change. The behavior of zone-boundary spin-wave energy is explained in terms of the extent of hybridization between one of the exchange-split $d_{x^2-y^2}$ band which is nearly half filled and the $d_{3z^2-r^2}$ band. The role of second-order antiferromagnetic superexchange process involving the inter-orbital hopping is also discussed.
We develop a novel self-consistent approach for studying the angle resolved photoemission spectra (ARPES) of a hole in the t-J-Holstein model giving perfect agreement with numerically exact Diagrammatic Monte Carlo data at zero temperature for all regimes of electron-phonon coupling. Generalizing the approach to finite temperatures we find that the anomalous temperature dependence of the ARPES in undoped cuprates is explained by cooperative interplay of coupling of the hole to magnetic fluctuations and strong electron-phonon interaction.
A recent observation of thermal Hall effect of magnetic origin in underdoped cuprates calls for critical re-examination of low-energy magnetic dynamics in undoped antiferromagnetic compound on square lattice, where traditional, renormalized spin-wave theory was believed to work well. Using Holstein-Primakoff boson formalism, we find that magnon-based theories can lead to finite Berry curvature in the magnon band once the Dzyaloshinskii-Moriya spin interaction is taken into account explicitly, but fail to produce non-zero thermal Hall conductivity. Assuming accidental doping by impurities and magnon scattering off of such impurity sites fails to predict skew scattering at the level of Born approximation. Local formation of skyrmion defects is also found incapable of generating magnon thermal Hall effect. Turning to spinon-based scenario, we write down a simple model by adding spin-dependent diagonal hopping to the well-known {pi}-flux model of spinons. The resulting two-band model has Chern number in the band structure, and generates thermal Hall conductivity whose magnetic field and temperature dependences mimic closely the observed thermal Hall signals. In disclaimer, there is no firm microscopic basis of this model and we do not claim to have found an explanation of the data, but given the unexpected nature of the experimental observation, it is hoped this work could serve as a first step towards reaching some level of understanding.
The optical conductivity sigma(omega) is calculated at finite temperature T for CuO_2 chain clusters within a pd-Hubbard model. Data at T = 300 K for Li_2CuO_2 are reanalyzed within this approach. The relative weights of Zhang-Rice singlet and triplet charge excitations near 2.5 and 4 eV, respectively, depend strongly on T, and a rather dramatic dependence of sigma(omega) on the ratio of the first to second neighbor exchange integrals is predicted. On the basis of these results, information about exchange interactionsfor frustrated edge-shared cuprates can be obtained from T-dependent optical spectra. Our results are also relevant for magnetically weakly coupled wide-gap insulators in general.
We investigate the high-energy magnetic excitation spectrum of the high-$T_c$ cuprate superconductor Bi$_2$Sr$_2$CaCu$_2$O$_{8+delta}$ (Bi-2212) using Cu $L_3$ edge resonant inelastic x-ray scattering (RIXS). Broad, dispersive magnetic excitations are observed, with a zone boundary energy of $sim$300 meV and a weak dependence on doping. These excitations are strikingly similar to the bosons proposed to explain the high-energy `kink observed in photoemission. A calculation of the spin-response based on the ARPES-derived electronic structure and YRZ-quasi-particles reproduces the key features of the observed magnetic dispersions with no adjustable parameters. These results show that it is possible to reconcile the magnetic and electronic properties of the cuprates within a unified framework.
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