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A. S. Moskvin

Publications and source records attributed to A. S. Moskvin.

At least 55 records · Page 3Linked to original sources
arXiv2012

Pseudogap phase in cuprates: oxygen orbital moments instead of circulating currents

Circulating current (CC) loops within the cuprate unit cell are proposed to play a key role in the physics of the pseudogap phase. However, main experimental observations motivated by this sophisticated proposal and seemingly supporting the CC model can be explained in frames of a simple and physically clear microscopic model. We argue that instead of a well-isolated Zhang-Rice (ZR) singlet $^1A_{1g}$ the ground state of the hole center [CuO$_4$]$^{5-}$ (cluster analog of Cu$^{3+}$ ion) in cuprates should be described by a complex $^1A_{1g}$-$^{1,3}B_{2g}$-$^{1,3}E_u$ multiplet, formed by a competition of conventional hybrid Cu 3d-O 2p $b_{1g}(σ)\propto d_{x^2 -y^2}$ state and {\it purely oxygen nonbonding} O 2p$π$ states with $a_{2g}(π)$ and $e_{ux,y}(π)$ symmetry. In contrast with inactive ZR singlet we arrive at several novel competing orbital and spin-orbital order parameters, e.g., Ising-like net orbital magnetic moment, orbital toroidal moment, intra-plaquette's staggered order of Ising-like oxygen orbital magnetic moments. As a most impressive validation of the non-ZR model we explain fascinating results of recent neutron scattering measurements that revealed novel type of magnetic ordering in pseudogap phase of several hole-doped cuprates.

cond-mat.str-el↗
arXiv2012

Unusual X-ray excited luminescence spectra of NiO suggestive of a self-trapping of the d-d charge transfer exciton

Luminescence spectra of NiO have been investigated under vacuum ultraviolet (VUV) and soft X-ray (XUV) excitation. Photoluminescence (PL) spectra show broad emission bands centered at about 2.3 and 3.2 eV. The PL excitation (PLE) spectral evolution and lifetime measurements reveal that two mechanisms with short and long decay times, attributed to the d($e_g$)-d($e_g$) and p($π$)-d charge transfer (CT) transitions in the range 4-6\,eV, respectively, are responsible for the observed emissions, while the most intensive p($σ$)-d CT transition at 7\,eV appears to be a weak if any PL excitation mechanism. The PLE spectra recorded in the 4-7\,eV range agree with the RIXS and reflectance data. Making use of the XUV excitation allows us to avoid the predominant role of the surface effects in luminescence and reveal bulk luminescence with puzzling well isolated doublet of very narrow lines with close energies near 3.3\,eV characteristic for recombination transitions in self-trapped \emph{d}-\emph{d} CT excitons formed by coupled Jahn-Teller Ni$^+$ and Ni$^{3+}$ centers. This conclusion is supported both by a comparative analysis of the luminescence spectra for NiO and solid solutions Ni$_{x}$Zn$_{1-x}$O, and by a comprehensive cluster model assignement of different \emph{p}-\emph{d} and \emph{d}-\emph{d} CT transitions, their relaxation channels. To the best of our knowledge it is the first observation of the self-trapping for \emph{d}-\emph{d} CT excitons. Our paper shows the time resolved luminescence measurements provide an instructive tool for elucidation of the \emph{p}-\emph{d} and \emph{d}-\emph{d} CT excitations and their relaxation in 3d oxides.

cond-mat.str-el↗
arXiv2011

What is the true charge transfer gap in parent insulating cuprates?

A large body of experimental data point towards a charge transfer instability of parent insulating cuprates to be their unique property. We argue that the true charge transfer gap in these compounds is as small as 0.4-0.5\,eV rather than 1.5-2.0\,eV as usually derived from the optical gap measurements. In fact we deal with a competition of the conventional (3d$^9$) ground state and a charge transfer (CT) state with formation of electron-hole dimers which evolves under doping to an unconventional bosonic system. Our conjecture does provide an unified standpoint on the main experimental findings for parent cuprates including linear and nonlinear optical, Raman, photoemission, photoabsorption, and transport properties anyhow related with the CT excitations. In addition we suggest a scenario for the evolution of the CuO$_2$ planes in the CT unstable cuprates under a nonisovalent doping.

cond-mat.str-el↗
arXiv2010

Spin polarization of the magnetic spiral in NaCu_2O_2, as seen by NMR

The incommensurate (IC) spin ordering in quasi-1D edge-shared cuprate NaCu_2O_2 has been studied by ^{23}Na nuclear magnetic resonance spectroscopy in an external magnetic field near 6 Tesla applied along the main crystallographic axes. The NMR lineshape evolution above and below T_N\approx12 K yields a clear signature of an IC static modulation of the local magnetic field consistent with a Cu^{2+} spin spiral polarized in the bc-plane rather than in the ab-plane as reported from earlier neutron diffraction data.

cond-mat.str-el↗
arXiv2010

Disproportionation and electronic phase separation in parent manganite LaMnO_3

Nominally pure undoped parent manganite LaMnO_3 exhibits a puzzling behavior inconsistent with a simple picture of an A-type antiferromagnetic insulator (A-AFI) with a cooperative Jahn-Teller ordering. We do assign its anomalous properties to charge transfer instabilities and competition between insulating A-AFI phase and metallic-like dynamically disproportionated phase formally separated by a first-order phase transition at T_{disp}=T_{JT}\approx 750 K. The unconventional high-temperature phase is addressed to be a specific electron-hole Bose liquid (EHBL) rather than a simple "chemically" disproportionated R(Mn^{2+}Mn^{4+})O_3 phase. New phase does nucleate as a result of the charge transfer (CT) instability and evolves from the self-trapped CT excitons, or specific EH-dimers, which seem to be a precursor of both insulating and metallic-like ferromagnetic phases observed in manganites. We arrive at highly frustrated system of triplet (e_g^2)^3A_{2g} bosons moving in a lattice formed by hole Mn^{4+} centers. Starting with different experimental data we have reproduced a typical temperature dependence of the volume fraction of high-temperature mixed-valent EHBL phase. We argue that a slight nonisovalent substitution, photo-irradiation, external pressure or magnetic field gives rise to an electronic phase separation with a nucleation or an overgrowth of EH-droplets. Such a scenario provides a comprehensive explanation of numerous puzzling properties observed in parent and nonisovalently doped manganite LaMnO_3 including an intriguing manifestation of superconducting fluctuations.

cond-mat.str-el↗
arXiv2010

Interplay of p-d and d-d charge transfer transitions in rare-earth perovskite manganites

We have performed both theoretical and experimental study of optical response of parent perovskite manganites RMnO_3 with a main goal to elucidate nature of clearly visible optical features. Starting with a simple cluster model approach we addressed the both one-center (p-d) and two-center (d-d) charge transfer (CT) transitions, their polarization properties, the role played by structural parameters, orbital mixing, and spin degree of freedom. Optical complex dielectric function of single crystalline samples of RMnO_3 (R=La, Pr, Nd, Sm, Eu) was measured by ellipsometric technique at room temperature in the spectral range from 1.0 to 5.0 eV for two light polarizations: E \parallel c and E \perp c. The comparative analysis of the spectral behavior of \varepsilon _1 and \varepsilon _2 is believed to provide a more reliable assignment of spectral features. We have found an overall agreement between experimental spectra and theoretical predictions based on the theory of one-center p-d CT transitions and inter-site d-d CT transitions. Our experimental data and theoretical analysis evidence a dual nature of the dielectric gap in nominally stoichiometric matrix of perovskite manganites RMnO_3, it is formed by a superposition of forbidden or weak dipole allowed p-d CT transitions and inter-site d-d CT transitions. In fact, the parent perovskite manganites RMnO_3 should rather be sorted neither into the CT insulator nor the Mott-Hubbard insulator in the Zaanen, Sawatzky, Allen scheme.

cond-mat.str-el↗
arXiv2009

Quantum electric dipole glass and frustrated magnetism near a critical point in Li2ZrCuO4

We report a new peculiar effect of the interaction between a sublattice of frustrated quantum spin-1/2 chains and a sublattice of pseudospin-1/2 centers (quantum electric dipoles) uniquely co-existing in the complex oxide Li2ZrCuO4. 7Li nuclear magnetic-, Cu2+ electron spin resonance and a complex dielectric constant data reveal that the sublattice of Li+-derived electric dipoles orders glass like at Tg ~ 70 K yielding a spin site nonequivalency in the CuO2 chains. We suggest that such a remarkable interplay between electrical and spin degrees of freedom might strongly influence the properties of the spiral spin state in Li2ZrCuO4 that is close to a quantum ferromagnetic critical point. In particular that strong quantum fluctuations and/or the glassy behavior of electric dipoles might renormalize the exchange integrals affecting this way the pitch angle of the spiral as well as be responsible for the missing multiferroicity present in other helicoidal magnets.

cond-mat.str-el↗
arXiv2009

Microscopic mechanisms of spin-dependent electric polarization in 3d oxides

We present a short critical overview of different microscopic models for nonrelativistic and relativistic magnetoelectric coupling including the so-called "spin current scenario", ab-initio calculations, and several recent microscopic approaches to a spin-dependent electric polarization in 3d oxides.

cond-mat.str-el↗
arXiv2008

Nonrelativistic Multiferroicity in the Nonstoichiometric Spin s=1/2 Spiral Chain Cuprate LiCu2O2

We argue for a recently observed puzzling multiferroic behavior in s=1/2 1D chain cuprate LiCu2O2 with edge-shared arrangement of CuO4 plaquettes and incommensurate spiral spin ordering can be consistently explained if one takes into account the nonrelativistic exchange-induced electric polarization on the Cu2+ centers substituting for the positions native for the Cu1+ ions. These substituent centers are proved to be an effective probe of the spin incommensurability and magnetic field effects.

cond-mat.str-el↗
arXiv2008

Multiferroicity due to nonstoichiometry in the chain cuprate LiVCuO_4

The recently observed multiferroic behavior in the s=1/2 chain cuprate LiVCuO_4 (LiCuVO_4) with edge-shared CuO_4 plaquettes and helical spin ordering does not agree with the existing theories such as a spin-current scenario. We argue that the effect can be consistently explained, if the exchange-induced electric polarization on the out-of-chain Cu^2+ centers substituting for Li-ions in LiVCuO_4 is taken into account. These substituent centers are proved to be an effective probe of the spin incommensurability and the magnetic field effects.

cond-mat.str-el↗
arXiv2007

Microscopic mechanisms of spin-dependent electric polarization in 3d oxides

We address a systematic microscopic theory of spin-dependent electric polarization in 3d oxides starting with a generic three-site two-hole cluster. A perturbation scheme realistic for 3d oxides is applied which implies the quenching of orbital moments by low-symmetry crystal field, strong intra-atomic correlations, the dp-transfer effects, and rather small spin-orbital coupling. An effective spin operator of the electric dipole moment is deduced incorporating both nonrelativistic and relativistic terms. The nonrelativistic electronic polarization mechanism related with the effects of the redistribution of the local on-site charge density due to $pd$ covalency and exchange coupling is believed to govern the multiferroic behaviour in 3d oxides. The relativistic exchange-dipole moment is mainly stems from the nonrelativistic one due to the perturbation effect of Dzyaloshinsky-Moriya coupling and is estimated to be a weak contributor to the electric polarization observed in the most of 3d multiferroics.

cond-mat.str-el↗
arXiv2006

Field induced antiferromagnetism and $^{17}$O Knight shift anomaly in La$_2$CuO$_4$

We address the effect of the field induced antiferromagnetism in paramagnetic state of the cuprate weak ferromagnet La$_2$CuO$_4$. The planar oxygen $^{17}$O Knight shift is shown to be an effective tool to inspect the effects of Dzyaloshinsky-Moriya coupling in cuprates in an external magnetic field. Field induced antiferromagnetism and anisotropic antiferromagnetic contribution to $^{17}$K explain the anomalies observed in $^{17}$O NMR in La$_2$CuO$_4$. The experimental observation of antiferromagnetic contribution to the $^{17}$O Knight shift provides probably the only way to find out the problem of the sense of Dzyaloshinsky vector in cuprates.

cond-mat.str-el↗
arXiv2006

Dzyaloshinsky-Moriya antisymmetric exchange coupling in cuprates: Oxygen effects

We revisit a problem of Dzyaloshinsky-Moriya antisymmetric exchange coupling for a single bond in cuprates specifying the local spin-orbital contributions to Dzyaloshinsky vector focusing on the oxygen term. The Dzyaloshinsky vector and respective weak ferromagnetic moment is shown to be a superposition of comparable and, sometimes, competing local Cu and O contributions. The intermediate oxygen $^{17}$O Knight shift is shown to be an effective tool to inspect the effects of Dzyaloshinsky-Moriya coupling in an external magnetic field. We predict the effect of $strong$ oxygen weak antiferromagnetism in edge-shared CuO$_2$ chains due to uncompensated oxygen Dzyaloshinsky vectors. Finally, we revisit the effects of symmetric spin anisotropy, in particular, those directly induced by Dzyaloshinsky-Moriya coupling.

cond-mat.str-el↗
arXiv2005

Charge states of strongly correlated 3d oxides: from typical insulator to unconventional electron-hole Bose liquid

We develop a model approach to describe charge fluctuations and different charge phases in strongly correlated 3d oxides. As a generic model system one considers that of centers each with three possible valence states described in frames of pseudo-spin (isospin) formalism by an effective anisotropic non-Heisenberg Hamiltonian. Simple uniform mean-field phases include an insulating monovalent phase, mixed-valence binary disproportionated phase, and mixed-valence ternary under-disproportionated phase. We consider two first phases in more details focusing on the problem of electron/hole states and different types of excitons in monovalent phase and formation of electron-hole Bose liquid in disproportionated phase. Pseudo-spin formalism provides a useful framework for revealing and describing different topological charge fluctuations, in particular, like domain walls or bubble domains in antiferromagnets. All the insulating systems such as monovalent phase may be subdivided to two classes: stable and unstable ones with regard to the formation of self-trapped charge transfer (CT) excitons. The latter systems appear to be unstable with regard to the formation of CT exciton clusters, or droplets of the electron-hole Bose liquid. The model approach suggested is believed to be applied to describe a physics of strongly correlated oxides with charge transfer excitonic instability and a mixed valence. We shortly discuss an unconventional scenario of the essential physics of cuprates and manganites that implies their instability with regard to the self-trapping of charge transfer excitons and the formation of electron-hole Bose liquid.

cond-mat.str-el↗
arXiv2005

Charge Transfer Excitations in Insulating Copper Oxides

A semi-quantitative cluster approach is developed to describe the charge transfer (CT) electron-hole excitations in insulating cuprates in a rather wide energy range up to 10- 15 eV. It generalizes the Zhang-Ng (ZN) model of CT excitons by considering the complete set of Cu3d and O2p orbitals within the CuO4 embedded molecular cluster method and by introducing one-center (intra-center) Frenkel-like and two-center (inter-center) excitons. Special attention is paid to the transition matrix element effects both in optical and electron energy loss spectra (EELS). In the latter case we obtain the momentum dependence of matrix elements both for intra-center and inter-center transitions. We are able to give a semi-quantitative description of the optical and EELS spectra for a large number of 0D (like CuB2O4), 1D (Sr2CuO3) and 2D (like Sr2CuO2Cl2) insulating cuprates in a unifying manner. By comparing our analysis with the experimental data we find that the CT gap in insulating cuprates is determined by nearly degenerate intra-center localized excitations and inter-center CT excitons. The corresponding EELS intensity is found to be strongly k-dependent: even for isolated exciton it sharply decreases by approaching the Brillouin zone (BZ) boundary. It is shown that the interaction of two-center excitons can result in destructive interference effects with an intensity compensation point.

cond-mat.str-el↗
arXiv2004

Comment on "Competition between helimagnetism and commensurate quantum spin correlations in LiCu2O2"

The microscopic origin of the recently observed helical structure in LiCu2O2 [1] is considered. It is shown that the frustrated antiferromagnetic double chain scenario adopted in Ref.1 is unrealistic. It should be replaced by a frustrated single-chain (CuO2) scenario proposed in Ref. 2 with ferromagnetic nearest neighbor and antiferromagnetic next nearest neighbor exchange integrals \. [1] T. Masuda et al. Phys. Rev. Lett. 92 (2004), 177201. [2] A. Gippius et al. Phys. Rev. B 70 (2004), R01426; cond-mat/0312576.

cond-mat.str-el↗
arXiv2004

Nonbonding oxygen holes and spinless scenario of magnetic response in doped cuprates

Both theoretical considerations and experimental data point to a more complicated nature of the valence hole states in doped cuprates than it is predicted by Zhang-Rice model. Actually, we deal with a competition of conventional hybrid Cu 3d-O 2p $b_{1g}\propto d_{x^2 -y^2}$ state and purely oxygen nonbonding state with $e_{u}x,y \propto p_{x,y}$ symmetry. The latter reveals a non-quenched Ising-like orbital moment that gives rise to a novel spinless purely oxygen scenario of the magnetic response in doped cuprates with the oxygen localized orbital magnetic moments of the order of tenths of Bohr magneton. We consider the mechanism of ${}^{63,65}$Cu-O 2p transferred orbital hyperfine interactions due to the mixing of the oxygen O 2p orbitals with Cu 3p semicore orbitals. Quantitative estimates point to a large magnitude of the respective contributions both to local field and electric field gradient, and their correlated character.

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