Long-Lived Higgs Modes in Strongly Correlated Condensates.

We investigate order parameter fluctuations in the Hubbard model within a time-dependent Gutzwiller approach. While in the weak coupling limit we find that the amplitude fluctuations are short-lived due to a degeneracy with the energy of the edge of the quasiparticle continua (and in agreement with Hartree-Fock+RPA theory), these are shifted below the edge upon increasing the interaction. Our calculations therefore predict undamped amplitude (Higgs) oscillations of the order parameter in strongly coupled superconductors, cold atomic fermion condensates, and strongly interacting charge- and spin-density wave systems. We propose an experimental realization for the detection of the spin-type Higgs mode in undoped cuprates and related materials where, due to the Dzyaloshinsky-Moriya interaction, it can couple to an out-of-plane ferromagnetic excitation that is visible via the Faraday effect.

Unexpected Coexisting Solid Solutions in the Quasi-Binary Ag(II) F2 /Cu(II) F2 Phase Diagram.

High-temperature solid-state reaction between orthorhombic AgF2 and monoclinic CuF2 (y=0.15, 0.3, 0.4, 0.5) in a fluorine atmosphere resulted in coexisting solid solutions of Cu-poor orthorhombic and Cu-rich monoclinic phases with stoichiometry Ag1-x Cux F2 . Based on X-ray powder diffraction analyses, the mutual solubility in the orthorhombic phase (AgF2 : Cu) appears to be at an upper limit of Cu concentration of 30 mol % (Ag0.7 Cu0.3 F2 ), while the monoclinic phase (CuF2 : Ag) can form a nearly stoichiometric Cu : Ag=1 : 1 solid solution (Cu0.56 Ag0.44 F2 ), preserving the CuF2 crystal structure. Experimental data and DFT calculations showed that AgF2 : Cu and CuF2 : Ag solid solutions deviate from the classical Vegard's law. Magnetic measurements of Ag1-x Cux F2 showed that the Néel temperature (TN ) decreases with increasing Cu content in both phases. Likewise, theoretical DFT+U calculations for Ag1-x Cux F2 showed that the progressive substitution of Ag by Cu decreases the magnetic interaction strength |J2D | in both structures. Electrical conductivity measurements of Ag0.85 Cu0.15 F2 showed a modest increase in specific ionic conductivity (3.71 ⋅ 10-13 ±2.6 ⋅ 10-15  S/cm) as compared to pure AgF2 (1.85 ⋅ 10-13± 1.2 ⋅ 10-15  S/cm), indicating the formation of a vacancy- or F adatom-free metal difluoride sample.

High-temperature charge density wave correlations in La1.875Ba0.125CuO4 without spin-charge locking.

Although all superconducting cuprates display charge-ordering tendencies, their low-temperature properties are distinct, impeding efforts to understand the phenomena within a single conceptual framework. While some systems exhibit stripes of charge and spin, with a locked periodicity, others host charge density waves (CDWs) without any obviously related spin order. Here we use resonant inelastic X-ray scattering to follow the evolution of charge correlations in the canonical stripe-ordered cuprate La1.875Ba0.125CuO4 across its ordering transition. We find that high-temperature charge correlations are unlocked from the wavevector of the spin correlations, signaling analogies to CDW phases in various other cuprates. This indicates that stripe order at low temperatures is stabilized by the coupling of otherwise independent charge and spin density waves, with important implications for the relation between charge and spin correlations in the cuprates.

Short range smectic order driving long range nematic order: example of cuprates.

We present a model for describing the combined presence of nematic and 'smectic' or stripe-like orders seen in recent scanning tunneling microscopy (STM) experiments on cuprates. The smectic order is treated as an electronic charge density wave with an associated Peierls distortion or a 'Pomeranchuk wave'. This primary order is restricted to nanoscale domains by disorder effects, while the secondary coupling to strain generates the nematic order with a considerably longer range. A variety of experimental results are shown to be consistent with our theoretical predictions.

Electronic polymers and soft-matter-like broken symmetries in underdoped cuprates.

Empirical evidence in heavy fermion, pnictide and other systems suggests that unconventional superconductivity appears associated to some form of real-space electronic order. For the cuprates, despite several proposals, the emergence of order in the phase diagram between the commensurate antiferromagnetic state and the superconducting state is not well understood. Here we show that in this regime doped holes assemble in 'electronic polymers'. Within a Monte Carlo study, we find that in clean systems by lowering the temperature the polymer melt condenses first in a smectic state and then in a Wigner crystal both with the addition of inversion symmetry breaking. Disorder blurs the positional order leaving a robust inversion symmetry breaking and a nematic order, accompanied by vector chiral spin order and with the persistence of a thermodynamic transition. Such electronic phases, whose properties are reminiscent of soft-matter physics, produce charge and spin responses in good accord with experiments.

Spin excitations of ferronematic order in underdoped cuprate superconductors.

High-temperature superconductors exhibit a characteristic hourglass-shaped spectrum of magnetic fluctuations which most likely contribute to the pairing glue in the cuprates. Recent neutron scattering experiments in strongly underdoped compounds have revealed a significant low energy anisotropy of these fluctuations which we explain by a model in which topological defects of the antiferromagnet clump to producing domain wall segments with ferronematic order. This state does not invoke global charge order but breaks C4 rotational and inversion symmetry. The incommensurability of the low doping charge-disordered state is in good agreement with experiment and interpolates smoothly with the incommensurability of the stripe phase at higher doping. Within linear spin-wave theory the dynamic structure factor is in very good agreement with inelastic neutron scattering data and can account for the observed energy dependent anisotropy.

Exact exchange-correlation potential of an ionic Hubbard model with a free surface.

In Kohn-Sham density functional theory (DFT) the interacting electron problem is mapped into a noninteracting problem in an effective potential v(KS). It is known that the charge gap of the interacting system is different from the gap of the effective problem due to a jump Δxc in v(KS) when an electron is added but its magnitude and its role in the ubiquitous discrepancy between the experimental gaps and approximate DFT computations is poorly understood. Here we compute the exact v(KS) of a strongly interacting one-dimensional lattice model which can be driven from an ionic to a Mott insulating state. Presence of a "vacuum" region allows to determine the absolute value of v(KS). We show that in the ionic regime Δxc is determined by nearest-neighbor interaction, while in the Mott regime Δxc is determined by on-site Hubbard interaction.

Superfluid density and phase relaxation in superconductors with strong disorder.

We consider the attractive Hubbard model with on-site disorder as a prototype of a disordered superconductor. We solve the Bogoliubov-de Gennes equations on two-dimensional finite clusters at zero temperature and evaluate the electromagnetic response to a vector potential. We find that the standard decoupling between transverse and longitudinal response does not apply in the presence of disorder. Moreover, the superfluid density is strongly reduced by the relaxation of the phase of the order parameter already at mean-field level when disorder is large. We also find that the anharmonicity of the phase fluctuations is strongly enhanced by disorder. Beyond mean field, this provides an enhancement of quantum fluctuations inducing a zero-temperature transition to a nonsuperconducting phase of disordered preformed pairs. Finally, the connection of our findings with the glassy physics for extreme dirty superconductors is discussed.

Model of quasiparticles coupled to a frequency-dependent charge-density-wave order parameter in cuprate superconductors.

We investigate a model where superconducting electrons are coupled to a frequency dependent charge-density wave order parameter Delta_{r}(omega). Our approach can reconcile the simultaneous existence of low-energy Bogoljubov quasiparticles and high energy electronic order as observed in scanning tunneling microscopy (STM) experiments. The theory accounts for the contrast reversal in the STM spectra between positive and negative bias observed above the pairing gap. An intrinsic relation between scattering rate and inhomogeneities follows naturally.

Competing orders in FeAs layers.

Using the unrestricted Hartree-Fock approximation and Landau theory we identify possible phases competing with superconductivity in FeAs layers. We find that close to half-filling the transition from the paramagnet to the magnetically ordered phase is first order, making anharmonicities relevant and leading to a rich phase diagram. Between the already known one-dimensionally modulated magnetic stripe phase and the paramagnet we find a new phase which has the same structure factor as the former but in which magnetic moments at nearest-neighbor sites are at right angles making electrons acquire a nontrivial phase when circulating a plaquette at strong coupling. Another competing phase has magnetic and charge order and may be stabilized by charged impurities.

Coulomb-frustrated phase separation phase diagram in systems with short-range negative compressibility.

Using numerical techniques and asymptotic expansions we obtain the phase diagram of a paradigmatic model of Coulomb-frustrated phase separation in systems with negative short-range compressibility. The transition from the homogeneous phase to the inhomogeneous phase is generically first order in isotropic three-dimensional systems except for a critical point. Close to the critical point, inhomogeneities are predicted to form a bcc lattice with subsequent transitions to a triangular lattice of rods and a layered structure. Inclusion of a strong anisotropy allows for second- and first-order transition lines joined by a tricritical point.

Theory of antibound states in partially filled narrow band systems.

We present a theory of the dynamical two-particle response function in the Hubbard model based on the time-dependent Gutzwiller approximation. The results are in excellent agreement with exact diagonalization on small clusters and are reliable even for high densities, where the usual ladder approximation breaks down. We apply the theory to the computation of antibound states relevant for Auger spectroscopy and cold atom physics.

Magnetic fluctuations of stripes in the high temperature cuprate superconductors.

Within the time-dependent Gutzwiller approximation for the Hubbard model we compute the magnetic fluctuations of vertical metallic stripes with parameters appropriate for La(1.875)Ba(0.125)CuO(4) (LBCO). For bond- and site-centered stripes the excitation spectra are similar, consisting of a low-energy incommensurate acoustic branch which merges into a "resonance peak" at the antiferromagnetic wave vector and several high-energy optical branches. The acoustic branch is similar to the result of theories assuming localized spins whereas the optical branches are significantly different. Results are in good agreement with a recent inelastic neutron study of LBCO.

Dynamics of metallic stripes in cuprates.

We study the dynamics of metallic vertical stripes in cuprates within the three-band Hubbard model based on a recently developed time-dependent Gutzwiller approximation. As doping increases, the optical conductivity shows transfer of spectral weight from the charge-transfer band towards (i) an incoherent band centered at 1.3 eV, (ii) a Drude peak, due mainly to motion along the stripe, and (iii) a low-energy collective mode which softens with doping and merges with (ii) at optimum doping in good agreement with experiment. The softening is related to the quasidegeneracy between Cu-centered and O-centered mean-field stripe solutions close to optimal doping.

Metallic mean-field stripes, incommensurability, and chemical potential in cuprates.

We perform a systematic slave-boson mean-field analysis of the three-band model for cuprates with first-principle parameters. Contrary to widespread belief based on earlier mean-field computations low doping stripes have a linear density close to 1/2 added hole per lattice constant. We find a dimensional crossover from 1D to 2D at doping approximately 0.1 followed by a breaking of particle-hole symmetry around doping 1/8 as doping increases. Our results explain in a simple way the behavior of the chemical potential, the magnetic incommensurability, and transport experiments as a function of doping. Bond centered and site-centered stripes become degenerate for small overdoping.

Time-dependent Gutzwiller approximation for the Hubbard model.

We develop a time-dependent Gutzwiller approximation (GA) for the Hubbard model analogous to the time-dependent Hartree-Fock (HF) method. This new formalism incorporates ground state correlations of the random phase approximation (RPA) type beyond the GA. Static quantities like ground state energy and double occupancy are in excellent agreement with exact results in one dimension up to moderate coupling and in two dimensions for all couplings. We find a substantial improvement over traditional GA and HF+RPA treatments. Dynamical correlation functions can be computed and are also substantially better than HF+RPA ones and obey well behaved sum rules.