2697 Publications

Regularizing 3D conformal field theories via anyons on the fuzzy sphere

Recently introduced ''fuzzy sphere'' method has enabled accurate numerical regularizations of certain three-dimensional (3D) conformal field theories (CFTs). The regularization is provided by the non-commutative geometry of the lowest Landau level filled by electrons, such that the charge is trivially gapped due to the Pauli exclusion principle at filling factor $ν=1$, while the electron spins encode the desired CFT. Successful applications of the fuzzy sphere to paradigmatic CFTs, such as the 3D Ising model, raise an important question: how finely tuned does the underlying electron system need to be? Here, we show that the 3D Ising CFT can also be realized at fractional electron fillings. In such cases, the CFT spectrum is intertwined with the charge-neutral spectrum of the underlying fractional quantum Hall (FQH) state -- a feature that is trivially absent in the previously studied $ν=1$ case. Remarkably, we show that the mixing between the CFT spectrum and the FQH spectrum is strongly suppressed within the numerically-accessible system sizes. Moreover, we demonstrate that the CFT critical point is unaffected by the exchange statistics of the particles and by the nature of topological order in the charge sector. Our results set the stage for the fuzzy-sphere exploration of conformal critical points between topologically-ordered states.
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Benchmarking Functionals for Strong-Field Light-Matter Interactions in Adiabatic Time-Dependent Density Functional Theory

In recent years, time-dependent density functional theory (TDDFT) has been extensively employed for highly nonlinear optics in molecules and solids, including high harmonic generation (HHG), photoemission, and more. TDDFT exhibits a relatively low numerical cost while still describing both light-matter and electron–electron interactions ab initio, making it highly appealing. However, the majority of implementations of the theory utilize the simplest possible approximations for the exchange-correlation (XC) functional–either the local density or generalized gradient approximations, which are traditionally considered to have rather poor chemical accuracy. We present the first systematic study of the XC functional effect on molecular HHG, testing various levels of theory. Our numerical results suggest justification for using simpler approximations for the XC functional, showing that hybrid and meta functionals (as well as Hartree–Fock) can, at times, lead to poor and unphysical results. The specific source of the failure in more elaborate functionals should be topic of future work, but we hypothesize that its origin might be connected to the adiabatic approximation of TDDFT.
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2024

Re-entrant phase transitions induced by localization of zero-modes

Common wisdom dictates that physical systems become less ordered when heated to higher temperature. However, several systems display the opposite phenomenon and move to a more ordered state upon heating, e.g. at low temperature piezoelectric quartz is paraelectric and it only becomes piezoelectric when heated to sufficiently high temperature. The presence, or better, the re-entrance of unordered phases at low temperature is more prevalent than one might think. Although specific models have been developed to understand the phenomenon in specific systems, a universal explanation is lacking. Here we propose a universal simple microscopic theory which predicts the existence of two critical temperatures in inhomogeneous systems, where the lower one marks the re-entrance into the less ordered phase. We show that the re-entrant phase transition is caused by disorder-induced spatial localization of the zero-mode on a finite, i.e. sub-extensive, region of the system. Specifically, this trapping of the zero-mode disconnects the fluctuations of the order parameter in distant regions of the system, thus triggering the loss of long-range order and the re-entrance into the disordered phase. This makes the phenomenon quite universal and robust to the underlying details of the model, and explains its ubiquitous observation.
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A Toffoli Gadget for Magnetic Tunnel Junctions Boltzmann Machines

Magnetic Tunnel Junctions (MTJs) are of great interest for non-conventional computing applications. The Toffoli gate is a universal reversible logic gate, enabling the construction of arbitrary boolean circuits. Here, we present a proof-of-concept construction of a gadget which encodes the Toffoli gate's truth table into the ground state of coupled uniaxial nanomagnets that could form the free layers of perpendicularly magnetized MTJs. This construction has three input bits, three output bits, and one ancilla bit. We numerically simulate the seven macrospins evolving under the stochastic Landau-Lifshitz-Gilbert (s-LLG) equation. We investigate the effect of the anisotropy-to-exchange-coupling strength ratio H
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Linear resistivity at van Hove singularities in twisted bilayer WSe2

Different mechanisms driving a linear temperature dependence of the resistivity ρ ∼ T at van Hove singularities (VHSs) or metal-insulator transitions when doping a Mott insulator are being debated intensively with competing theoretical proposals. We experimentally investigate this using the exceptional tunability of twisted bilayer (TB) WSe2 by tracking the parameter regions where linear-in-T resistivity is found in dependency of displacement fields, filling, and magnetic fields. We find that even when the VHSs are tuned rather far away from the half-filling point and the Mott insulating transition is absent, the T-linear resistivity persists at the VHSs. When doping away from the VHSs, the T-linear behavior quickly transitions into a Fermi liquid behavior with a T2 relation. No apparent dependency of the linear-in-T resistivity, besides a rather strong change of prefactor, is found when applying displacement fields as long as the filling is tuned to the VHSs, including D ∼ 0.28 V/nm where a high-order VHS is expected. Intriguingly, such non-Fermi liquid linear-in-T resistivity persists even when magnetic fields break the spin-degeneracy of the VHSs at which point two linear in T regions emerge, for each of the split VHSs separately. This points to a mechanism of enhanced scattering at generic VHSs rather than only at high-order VHSs or by a quantum critical point during a Mott transition. Our findings provide insights into the many-body consequences arising out of VHSs, especially the non-Fermi liquid behavior found in moiré materials.
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2024

Design and characterization of all two-dimensional fragile topological bands

Designing topological materials with specific topological indices is a complex inverse problem, traditionally tackled through manual, intuition-driven methods that are neither scalable nor efficient for exploring the vast space of possible material configurations. In this work, we develop an algorithm that leverages the covariance matrix adaptation evolution strategy to optimize the Fourier representation of the periodic functions shaping the designer material's characteristics. This includes mass profiles or dielectric tensors for phononic and photonic crystals, respectively, as much as synthetic potentials applicable to electronic and ultra-cold atomic systems. We demonstrate our methodology with a detailed characterization of a class of topological bands known as "fragile topological", showcasing the algorithm's capability to address both topological characteristics and spectral quality. This automation not only streamlines the design process but also significantly expands the potential for identifying and constructing high quality designer topological materials across the wide range of platforms, and is readily extendable to other setups, including higher-dimensional and non-linear systems.
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Doping-dependent charge-and spin-density wave orderings in a monolayer of Pb adatoms on Si (111)

In this work we computed the phase diagram as a function of temperature and doping for a system of lead adatoms allocated periodically on a silicon (111) surface. This Si(111):Pb material is characterized by a strong and long-ranged Coulomb interaction, a relatively large value of the spin-orbit coupling, and a structural phase transition that occurs at low temperature. In order to describe the collective electronic behavior in the system, we perform many-body calculations consistently taking all these important features into account. We find that charge- and spin-density wave orderings coexist with each other in several regions of the phase diagram. This result is in agreement with the recent experimental observation of a chiral spin texture in the charge density wave phase in this material. We also find that geometries of the charge and spin textures strongly depend on the doping level. The formation of such a rich phase diagram in the Si(111):Pb material can be explained by a combined effect of the lattice distortion and electronic correlations.
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Phonon-mediated unconventional superconductivity in rhombohedral stacked multilayer graphene

Understanding the origin of superconductivity in correlated two-dimensional materials is a key step in leveraging material engineering techniques for next-generation nanoscale devices. While it is widely accepted that phonons fluctuations only mediate conventional (s-wave) superconductivity, the common phenomenology of superconductivity in Bernal bilayer and rhombohedral trilayer graphene, as well as in a large family of graphene-based moiré systems, suggests a common superconducting mechanism across these platforms. In particular, in all these platforms some superconducting regions violate the Pauli limit, indicating unconventional superconductivity, naively ruling out conventional phonon-mediated pairing as the underlying mechanism. Here we combine first principles simulations with effective low-energy theories to investigate the superconducting mechanism and pairing symmetry in rhombohedral stacked graphene multilayers. We find that phonon-mediated superconductivity explains the main experimental findings, namely the displacement field and doping level dependence of the critical temperature, and the presence of two superconducting regions with different pairing symmetries that depend on the parent normal state. In particular, we find that intra-valley phonon scattering favors a triplet f-wave pairing when combined with electronic correlations stabilizing a spin- and valley-polarized normal state. We also propose a so far unexplored superconducting region at higher hole doping densities nh≈4×1012cm−2, and demonstrate how this highly hole-doped regime can be reached in heterostructures consisting of monolayer α-RuCl3 and rhombohedral trilayer graphene. Our findings promote phonon-mediated pairing as a strong contender to explain superconductivity across a wide range of graphene platforms, and demonstrate that phonons can, in fact, stabilize unconventional superconducting orders.
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2024
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