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Rafael M. Fernandes

Publications and source records attributed to Rafael M. Fernandes.

At least 109 records · Page 6Linked to original sources

Fracton-elasticity duality in twisted moiré superlattices

We formulate a fracton-elasticity duality for twisted moiré superlattices, taking into account that they are incommensurate crystals with dissipative phason dynamics. From a dual tensor-gauge formulation, as compared to standard crystals, we identify twice the number of conserved charges that describe topological lattice defects, namely, disclinations and a new type of defect that we dub discompressions. The key implication of these conservation laws is that both glide and climb motions of lattice dislocations are suppressed, indicating that dislocation networks may become exceptionally stable. Our results also apply to other planar incommensurate crystals and quasicrystals.

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Anomalous Transport in High-Mobility Superconducting SrTiO$_3$ Thin Films

The study of subtle effects on transport in semiconductors requires high-quality epitaxial structures with low defect density. Using hybrid molecular beam epitaxy (MBE), SrTiO$_3$ films with low-temperature mobility exceeding 42,000 cm$^2$V$^{-1}$s$^{-1}$ at low carrier density of 3 x 10$^{17}$ cm$^{-3}$ were achieved. A sudden and sharp decrease in residual resistivity accompanied by an enhancement in the superconducting transition temperature were observed across the second Lifshitz transition (LT) where the third band becomes occupied, revealing dominant intra-band scattering. These films further revealed an anomalous behavior in the Hall carrier density as a consequence of the antiferrodistortive (AFD) transition and the temperature-dependence of the Hall scattering factor. Using hybrid MBE growth, phenomenological modeling, temperature-dependent transport measurements, and scanning superconducting quantum interference device imaging, we provide critical insights into the important role of inter- vs intra-band scattering and of AFD domain walls on normal-state and superconducting properties of SrTiO$_3$.

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Revealing the competition between charge-density wave and superconductivity in CsV$_3$Sb$_5$ through uniaxial strain

In this paper we report the impact of uniaxial strain $\varepsilon$ applied along the crystalline $a$ axis on the newly discovered kagome superconductor CsV$_3$Sb$_5$. At ambient conditions, CsV$_3$Sb$_5$ shows a charge-density wave (CDW) transition at $T_{\rm CDW}=94.5$ K and superconducts below $T_C = 3.34$ K. In our study, when the uniaxial strain $\varepsilon$ is varied from $-0.90\%$ to $0.90\%$, $T_C$ monotonically increases by $\sim 33\%$ from 3.0 K to 4.0 K, giving rise to the empirical relation $T_C (\varepsilon)=3.4+0.56\varepsilon+0.12\varepsilon^2$. On the other hand, for $\varepsilon$ changing from $-0.76\%$ to $1.26\%$, $T_{\rm CDW}$ decreases monotonically by $\sim 10\%$ from 97.5 K to 87.5 K with $T_{\rm CDW}(\varepsilon)=94.5-4.72\varepsilon-0.60\varepsilon^2$. The opposite response of $T_C$ and $T_{\rm CDW}$ to the uniaxial strain suggests strong competition between these two orders. Comparison with hydrostatic pressure measurements indicate that it is the change in the $c$-axis that is responsible for these behaviors of the CDW and superconducting transitions, and that the explicit breaking of the sixfold rotational symmetry by strain has a negligible effect. Combined with our first-principles calculations and phenomenological analysis, we conclude that the enhancement in $T_C$ with decreasing $c$ is caused primarily by the suppression of $T_{\rm CDW}$, rather than strain-induced modifications in the bare superconducting parameters. We propose that the sensitivity of $T_{\rm CDW}$ with respect to the changes in the $c$-axis arises from the impact of the latter on the trilinear coupling between the $M_1^+$ and $L_2^-$ phonon modes associated with the CDW. Overall, our work reveals that the $c$-axis lattice parameter, which can be controlled by both pressure and uniaxial strain, is a powerful tuning knob for the phase diagram of CsV$_3$Sb$_5$.

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Theory of the charge-density wave in $A$V$_3$Sb$_5$ kagome metals

The family of metallic kagome compounds $A$V$_3$Sb$_5$ ($A$=K, Rb, Cs) was recently discovered to exhibit both superconductivity and charge order. The nature of the charge-density wave (CDW) phase is presently unsettled, which complicates the interpretation of the superconducting ground state. In this paper, we use group-theory and density-functional theory (DFT) to derive and solve a phenomenological Landau model for this CDW state. The DFT results reveal three unstable phonon modes with the same in-plane momentum but different out-of-plane momenta, whose frequencies depend strongly on the electronic temperature. This is indicative of an electronically-driven CDW, stabilized by features of the in-plane electronic dispersion. Motivated by the DFT analysis, we construct a Landau free-energy expansion for coupled CDW order parameters with wave-vectors at the $M$ and $L$ points of the hexagonal Brillouin zone. We find an unusual trilinear term coupling these different order parameters, which can promote the simultaneous condensation of both CDWs even if the two modes are not nearly-degenerate. We classify the different types of coupled multi-$\bf{Q}$ CDW orders, focusing on those that break the sixfold rotational symmetry and lead to a unit-cell doubling along all three crystallographic directions, as suggested by experiments. We determine a region in parameter space, characterized by large nonlinear Landau coefficients, where these phases - dubbed staggered tri-hexagonal and staggered Star-of-David - are the leading instabilities of the system. Finally, we discuss the implications of our results for the kagome metals.

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Electric-field-tunable electronic nematic order in twisted double-bilayer graphene

Graphene-based moiré systems have attracted considerable interest in recent years as they display a remarkable variety of correlated phenomena. Besides insulating and superconducting phases in the vicinity of integer fillings of the moiré unit cell, there is growing evidence for electronic nematic order both in twisted bilayer graphene and twisted double-bilayer graphene (tDBG), as signaled by the spontaneous breaking of the threefold rotational symmetry of the moiré superlattices. Here, we combine symmetry-based analysis with a microscopic continuum model to investigate the structure of the nematic phase of tDBG and its experimental manifestations. First, we perform a detailed comparison between the theoretically calculated local density of states and recent scanning tunneling microscopy data [arXiv:2009.11645] to resolve the internal structure of the nematic order parameter in terms of the layer, sublattice, spin, and valley degrees of freedom. We find strong evidence that the dominant contribution to the nematic order parameter comes from states at the moiré scale rather than at the microscopic scale of the individual graphene layers, which demonstrates the key role played by the moiré degrees of freedom and confirms the correlated nature of the nematic phase in tDBG. Secondly, our analysis reveals an unprecedented tunability of the orientation of the nematic director in tDBG by an externally applied electric field, allowing the director to rotate away from high-symmetry crystalline directions. We compute the expected fingerprints of this rotation in both STM and transport experiments, providing feasible ways to probe it. Rooted in the strong sensitivity of the flat bands of tDBG to the displacement field, this effect opens an interesting route to the electrostatic control of electronic nematicity in moiré systems.

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Understanding Magnetic Phase Coexistence in Ru$_2$Mn$_{1-x}$Fe$_x$Sn Heusler Alloys: A Neutron Scattering, Thermodynamic, and Phenomenological Analysis

The random substitutional solid solution between the antiferromagnetic (AFM) full-Heusler alloy Ru$_2$MnSn and the ferromagnetic (FM) full-Heusler alloy Ru$_2$FeSn provides a rare opportunity to study FM-AFM phase competition in a near-lattice-matched, cubic system, with full solubility. At intermediate $x$ in Ru$_2$Mn$_{1-x}$Fe$_x$Sn this system displays suppressed magnetic ordering temperatures, spatially coexisting FM and AFM order, and strong coercivity enhancement, despite rigorous chemical homogeneity. Here, we construct the most detailed temperature- and $x$-dependent understanding of the magnetic phase competition and coexistence in this system to date, combining wide-temperature-range neutron diffraction and small-angle neutron scattering with magnetometry and specific heat measurements on thoroughly characterized polycrystals. A complete magnetic phase diagram is generated, showing FM-AFM coexistence between $x \approx 0.30$ and $x \approx 0.70$. Important new insight is gained from the extracted length scales for magnetic phase coexistence (25-100 nm), the relative magnetic volume fractions and ordering temperatures, in addition to remarkable $x$-dependent trends in magnetic and electronic contributions to specific heat. An unusual feature in the magnetic phase diagram (an intermediate FM phase) is also shown to arise from an extrinsic effect related to a minor Ru-rich secondary phase. The established magnetic phase diagram is then discussed with the aid of phenomenological modeling, clarifying the nature of the mesoscale phase coexistence with respect to the understanding of disordered Heisenberg models.

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The essential role of magnetic frustration in the phase diagrams of doped cobaltites

Doped perovskite cobaltites (e.g., La$_{1-x}$Sr$_x$CoO$_3$) have been extensively studied for their spin-state physics, electronic inhomogeneity, and insulator-metal transitions. Ferromagnetically-interacting spin-state polarons emerge at low $x$ in the phase diagram of these compounds, eventually yielding long-range ferromagnetism. The onset of long-range ferromagnetism ($x \approx 0.18$) is substantially delayed relative to polaron percolation ($x \approx 0.05$), however, generating a troubling inconsistency. Here, Monte-Carlo simulations of a disordered classical spin model are used to establish that previously ignored magnetic frustration is responsible for this effect, enabling faithful reproduction of the magnetic phase diagram.

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Phenomenological model for the third-harmonic magnetic response of superconductors: application to Sr$_{2}$RuO$_{4}$

We employ the phenomenological Lawrence-Doniach model to compute the contributions of the superconducting fluctuations to the third-harmonic magnetic response, denoted here by $\overline{M_{3}}$, which can be measured in a precise way using ac magnetic fields and lock-in techniques. We show that, in an intermediate temperature regime, this quantity behaves as the third-order nonlinear susceptibility, which shows a power-law dependence with the reduced temperature $ε=\frac{T-T_{c}}{T_{c}}$ as $ε^{-5/2}$. Very close to $T_{c}$, however, $\overline{M_{3}}$ saturates due to the nonzero amplitude of the ac field. We compare our theoretical results with experimental data for three conventional superconductors -- lead, niobium, and vanadium -- and for the unconventional superconductor Sr$_{2}$RuO$_{4}$ (SRO). We find good agreement between theory and experiment for the elemental superconductors, although the theoretical values for the critical field systematically deviate from the experimental ones. In the case of SRO, however, the phenomenological model completely fails to describe the data, as the third-harmonic response remains sizable over a much wider reduced temperature range compared to Pb, Nb, and V. We show that an inhomogeneous distribution of $T_{c}$ can partially account for this discrepancy, since regions with a locally higher $T_{c}$ contribute to the fluctuation $\overline{M_{3}}$ significantly more than regions with the "nominal" $T_{c}$ of the clean system. However, the exponential temperature dependence of $\overline{M_{3}}$ first reported in Ref. [3] is not captured by the model with inhomogeneity. We conclude that, while inhomogeneity is an important ingredient to understand the superconducting fluctuations of SRO and other perovskite superconductors, additional effects may be at play, such as non-Gaussian fluctuations or rare-region effects.

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Robust Gapless Superconductivity in 4Hb-TaS$_2$

The superconducting TMD 4Hb-TaS$_2$ consists of alternating layers of H and T structures, which in their bulk form are metallic and Mott-insulating, respectively. Recently, this compound has been proposed as a candidate chiral superconductor, due to an observed enhancement of the muon spin relaxation at $T_c$. 4Hb-TaS$_2$ also exhibits a puzzling $T$-linear specific heat at low temperatures, which is unlikely to be caused by disorder. Elucidating the origin of this behavior is an essential step in discerning the true nature of the superconducting ground state. Here, we propose a simple model that attributes the $T$-linear specific heat to the emergence of a robust multi-band gapless superconducting state. We show that an extended regime of gapless superconductivity naturally appears when the pair-breaking scattering rate on distinct Fermi-surface pockets differs significantly, and the pairing interaction is predominantly intra-pocket. Using a tight-binding model derived from first-principle calculations, we show that the pair-breaking scattering rate promoted by slow magnetic fluctuations on the T layers, which arise from proximity to a Mott transition, can be significantly different in the various H-layer dominated Fermi pockets depending on their hybridization with T-layer states. Thus, our results suggest that the ground state of 4Hb-TaS$_2$ consists of Fermi pockets displaying gapless superconductivity, which are shunted by superconducting Fermi pockets that are nearly decoupled from the T-layers.

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Strong-coupling expansion of multi-band interacting models: mapping onto the transverse-field $J_1$-$J_2$ Ising model

We investigate a class of two-dimensional two-band microscopic models in which the inter-band repulsive interactions play the dominant role. We first demonstrate three different schemes of constraining the ratios between the three types of inter-band interactions -- density-density, spin exchange, and pair-hopping -- that render the model free of the fermionic sign-problem for any filling and, consequently, amenable to efficient Quantum Monte Carlo simulations. We then study the behavior of these sign-problem-free models in the strong-coupling regime. In the cases where spin-rotational invariance is preserved or lowered to a planar symmetry, the strong-coupling ground state is a quantum paramagnet. However, in the case where there is only a residual Ising symmetry, the strong-coupling expansion maps onto the transverse-field $J_1$-$J_2$ Ising model, whose pseudospins are associated with local inter-band magnetic order. We show that by varying the band structure parameters within a reasonable range of values, a variety of ground states and quantum critical points can be accessed in the strong-coupling regime, some of which are not realized in the weak-coupling regime. We compare these results with the case of the single-band Hubbard model, where only intra-band repulsion is present, and whose strong-coupling behavior is captured by a simple Heisenberg model.

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Correlation-induced insulating topological phases at charge neutrality in twisted bilayer graphene

Twisted bilayer graphene (TBG) provides a unique framework to elucidate the interplay between strong correlations and topological phenomena in two-dimensional systems. The existence of multiple electronic degrees of freedom -- charge, spin, and valley -- gives rise to a plethora of possible ordered states and instabilities. Identifying which of them are realized in the regime of strong correlations is fundamental to shed light on the nature of the superconducting and correlated insulating states observed in the TBG experiments. Here, we use unbiased, sign-problem-free quantum Monte Carlo simulations to solve an effective interacting lattice model for TBG at charge neutrality. Besides the usual cluster Hubbard-like repulsion, this model also contains an assisted hopping interaction that emerges due to the non-trivial topological properties of TBG. Such a non-local interaction fundamentally alters the phase diagram at charge neutrality, gapping the Dirac cones even for infinitesimally small interaction. As the interaction strength increases, a sequence of different correlated insulating phases emerge, including a quantum valley Hall state with topological edge states, an intervalley-coherent insulator, and a valence bond solid. The charge-neutrality correlated insulating phases discovered here provide the sought-after reference states needed for a comprehensive understanding of the insulating states at integer fillings and the proximate superconducting states of TBG.

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Charge-$4e$ superconductivity from multi-component nematic pairing: Application to twisted bilayer graphene

We show that unconventional nematic superconductors with multi-component order parameter in lattices with three-fold and six-fold rotational symmetries support a charge-$4e$ vestigial superconducting phase above $T_c$. The charge-$4e$ state, which is a condensate of four-electron bound states that preserve the rotational symmetry of the lattice, is nearly degenerate with a competing vestigial nematic state, which is non-superconducting and breaks the rotational symmetry. This robust result is the consequence of a hidden discrete symmetry in the Ginzburg-Landau theory, which permutes quantities in the gauge sector and in the crystalline sector of the symmetry group. We argue that random strain generally favors the charge-$4e$ state over the nematic phase, as it acts as a random-mass to the former but as a random-field to the latter. Thus, we propose that two-dimensional inhomogeneous systems displaying nematic superconductivity, such as twisted bilayer graphene, provide a promising platform to realize the elusive charge-$4e$ superconducting phase.

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Topological and nematic superconductivity mediated by ferro-SU(4) fluctuations in twisted bilayer graphene

We propose an SU(4) spin-valley-fermion model to investigate the superconducting instabilities of twisted bilayer graphene (TBG). In this approach, bosonic fluctuations associated with an emergent SU(4) symmetry, corresponding to combined rotations in valley and spin spaces, couple to the low-energy fermions that comprise the flat bands. These fluctuations are peaked at zero wave-vector, reflecting the "ferromagnetic-like" SU(4) ground state recently found in strong-coupling solutions of microscopic models for TBG. Focusing on electronic states related to symmetry-imposed points of the Fermi surface, dubbed here "valley hot-spots" and "van Hove hot-spots", we find that the coupling to the itinerant electrons partially lifts the huge degeneracy of the ferro-SU(4) ground state manifold, favoring inter-valley order, spin-valley coupled order, ferromagnetic order, spin-current order, and valley-polarized order, depending on details of the band structure. These fluctuations, in turn, promote attractive pairing interactions in a variety of closely competing channels, including a nodeless $f$-wave state, a nodal $i$-wave state, and topological $d+id$ and $p+ip$ states with unusual Chern numbers $2$ and $4$, respectively. Nematic superconductivity, although not realized as a primary instability of the system, still appears as a consequence of the near-degeneracy of superconducting order parameters that transform as one-dimensional and two-dimensional irreducible representations of the point group $D_{6}$.

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Modeling unconventional superconductivity at the crossover between strong and weak electronic interactions

High-temperature superconductivity emerges in a host of different quantum materials, often in a region of the phase diagram where the electronic kinetic energy is comparable in magnitude with the electron-electron Coulomb repulsion. Describing such an intermediate-coupling regime has proven challenging, as standard perturbative approaches are inapplicable. Hence, it is of enormous interest to find models that are amenable to be solved using exact methods. While important advances have been made in elucidating the properties of one such minimal model -- the Hubbard model -- via numerical simulations, the infamous fermionic sign-problem significantly limits the accessible parameter space. Here, we employ Quantum Monte Carlo (QMC) methods to solve a multi-band version of the Hubbard model that does not suffer from the sign-problem and in which only repulsive interband interactions are present. In contrast to previous sign-problem-free QMC studies, this model does not have pre-existing fine-tuned magnetic order, and thus treats superconducting, magnetic, and charge degrees of freedom on an equal footing. We find that, as the electron-electron repulsion increases, a dome of antiferromagnetic order emerges in the intermediate-coupling regime, accompanied by a metal-to-insulator crossover line. Superconductivity is found only near the antiferromagnetic quantum phase transition located on the metallic side of the magnetic dome. Across the antiferromagnetic quantum phase transition we find a change in the dynamical character of the magnetic fluctuations, from slow and overdamped in the metallic side to fast and propagating in the insulating side. Our findings shed new light on the intertwining between superconductivity, magnetism, and charge correlations in quantum materials.

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Evolution of nematic fluctuations in CaK(Fe$_{1-x}$Ni$_{x}$)$_{4}$As$_{4}$ with spin-vortex crystal magnetic order

The CaK(Fe$_{1-x}$Ni$_{x}$)$_{4}$As$_{4}$ superconductors resemble the archetypal 122-type iron-based materials but have a crystal structure with distinctly lower symmetry. This family hosts one of the few examples of the so-called spin-vortex crystal magnetic order, a non-collinear magnetic configuration that preserves tetragonal symmetry, in contrast to the orthorhombic collinear stripe-type magnetic configuration common to the 122-type systems. Thus, nematic order is completely absent from its phase diagram. To investigate the evolution of nematic fluctuations in such a case, we present elastoresistance and elastic modulus measurements in CaK(Fe$_{1-x}$Ni$_{x}$)$_{4}$As$_{4}$ ($x = 0-0.05$) combined with phenomenological modeling and density functional theory. We find clear experimental signatures of considerable nematic fluctuations, including softening of the Young's modulus $Y_{[110]}$ and a Curie-Weiss type divergence of the B2g elastoresistance coefficient in CaK(Fe$_{0.951}$Ni$_{0.049}$)$_4$As$_4$. Overall, nematic fluctuations within this series bear strong similarities to the hole-doped Ba$_{1-x}$K$_x$Fe$_2$As$_2$ series, including a substitution-induced sign change. Our theoretical analysis addresses the effect of the specific crystal symmetry of the 1144-type structure in determining its magnetic ground state and on the nematic fluctuations.

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Inhomogeneous time-reversal symmetry breaking in $\mathrm{Sr}_{2}\mathrm{Ru}\mathrm{O}_{4}$

We show that the observed time-reversal symmetry breaking (TRSB) of the superconducting state in $\mathrm{Sr}_{2}\mathrm{Ru}\mathrm{O}_{4}$ can be understood as originating from inhomogeneous strain fields near edge dislocations of the crystal. Specifically, we argue that, without strain inhomogeneities, $\mathrm{Sr}_{2}\mathrm{Ru}\mathrm{O}_{4}$ is a single-component, time-reversal symmetric superconductor, likely with $d_{x^{2}-y^{2}}$ symmetry. However, due to the strong strain inhomogeneities generated by dislocations, a slowly-decaying sub-leading pairing state contributes to the condensate in significant portions of the sample. As it phase winds around the dislocation, time-reversal symmetry is locally broken. Global phase locking and TRSB occur at a sharp Ising transition that is not accompanied by a change of the single-particle gap and yields a very small heat capacity anomaly. Our model thus explains the puzzling absence of a measurable heat capacity anomaly at the TRSB transition in strained samples, and the dilute nature of the time-reversal symmetry broken state probed by muon spin rotation experiments. We propose that plastic deformations of the material may be used to manipulate the onset of broken time-reversal symmetry.

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Universal moiré nematic phase in twisted graphitic systems

Graphene moiré superlattices display electronic flat bands. At integer fillings of these flat bands, energy gaps due to strong electron-electron interactions are generally observed. However, the presence of other correlation-driven phases in twisted graphitic systems at non-integer fillings is unclear. Here, we report scanning tunneling microscopy (STM) measurements that reveal the existence of threefold rotational (C3) symmetry breaking in twisted double bilayer graphene (tDBG). Using spectroscopic imaging over large and uniform areas to characterize the direction and degree of C3 symmetry breaking, we find it to be prominent only at energies corresponding to the flat bands and nearly absent in the remote bands. We demonstrate that the C3 symmetry breaking cannot be explained by heterostrain or the displacement field, and is instead a manifestation of an interaction-driven electronic nematic phase, which emerges even away from integer fillings. Comparing our experimental data with a combination of microscopic and phenomenological modeling, we show that the nematic instability is not associated with the local scale of the graphene lattice, but is an emergent phenomenon at the scale of the moiré lattice, pointing to the universal character of this ordered state in flat band moiré materials.

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Phonon dynamics in the Kitaev spin liquid

The search for fractionalization in quantum spin liquids largely relies on their decoupling with the environment. However, the spin-lattice interaction is inevitable in a real setting. While the Majorana fermion evades a strong decay due to the gradient form of spin-lattice coupling, the study of the phonon dynamics may serve as an indirect probe of fractionalization of spin degrees of freedom. Here we propose that the signatures of fractionalization can be seen in the sound attenuation and the Hall viscosity. Despite the fact that both quantities can be related to the imaginary part of the phonon self-energy, their origins are quite different, and the time-reversal symmetry breaking is required for the Hall viscosity. First, we compute the sound attenuation due to a phonon scattering off of a pair of Majorana fermions and show that it is linear in temperature ($\sim T$). We argue that it has a particular angular dependence providing the information about the spin-lattice coupling and the low-energy Majorana fermion spectrum. The observable effects in the absence of time-reversal symmetry are then analyzed. We obtain the phonon Hall viscosity term from the microscopic Hamiltonian with time-reversal symmetry breaking term. Importantly, the Hall viscosity term mixes the longitudinal and transverse phonon modes and renormalize the spectrum in a unique way, which may be probed in spectroscopy measurement.

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