Publications by authors named "Domenico Di Sante"

Tunable quantum materials hold great potential for applications. Of special interest are materials in which small lattice strain induces giant electronic responses. The kagome compounds AVSb (A = K, Rb, Cs) provide a testbed for electronic tunable states.

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Engineering surfaces and interfaces of materials promises great potential in the field of heterostructures and quantum matter designers, with the opportunity to drive new many-body phases that are absent in the bulk compounds. Here, we focus on the magnetic Weyl kagome system CoSnS and show how for the terminations of different samples the Weyl points connect differently, still preserving the bulk-boundary correspondence. Scanning tunneling microscopy has suggested such a scenario indirectly, and here, we probe the Fermiology of CoSnS directly, by linking it to its real space surface distribution.

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Optical spectroscopy of ultimately thin materials has significantly enhanced our understanding of collective excitations in low-dimensional semiconductors. This is particularly reflected by the rich physics of excitons in atomically thin crystals which uniquely arises from the interplay of strong Coulomb correlation, spin-orbit coupling (SOC), and lattice geometry. Here we extend the field by reporting the observation of room temperature excitons in a material of non-trivial global topology.

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Article Synopsis
  • The study focuses on reducing the complexity of the four-point vertex function related to the functional renormalization group (FRG) flow in the two-dimensional t-t’ Hubbard model on a square lattice.
  • Using a deep learning approach that employs a neural ordinary differential equation solver, the researchers effectively model the FRG dynamics and identify different magnetic and superconducting phases.
  • The analysis reveals that only a few key modes are needed to represent the FRG dynamics, showcasing the potential of artificial intelligence to simplify and enhance our understanding of complex electron interactions in quantum field theory.
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Atomic layers deposited on semiconductor substrates introduce a platform for the realization of the extended electronic Hubbard model, where the consideration of electronic repulsion beyond the on-site term is paramount. Recently, the onset of superconductivity at 4.7 K has been reported in the hole-doped triangular lattice of tin atoms on a silicon substrate.

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The formation and the evolution of electronic metallic states localized at the surface, commonly termed 2D electron gas (2DEG), represents a peculiar phenomenon occurring at the surface and interface of many transition metal oxides (TMO). Among TMO, titanium dioxide (TiO ), particularly in its anatase polymorph, stands as a prototypical system for the development of novel applications related to renewable energy, devices and sensors, where understanding the carrier dynamics is of utmost importance. In this study, angle-resolved photo-electron spectroscopy (ARPES) and X-ray absorption spectroscopy (XAS) are used, supported by density functional theory (DFT), to follow the formation and the evolution of the 2DEG in TiO thin films.

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The recent discovery of AV_{3}Sb_{5} (A=K,Rb,Cs) has uncovered an intriguing arena for exotic Fermi surface instabilities in a kagome metal. Among them, superconductivity is found in the vicinity of multiple van Hove singularities, exhibiting indications of unconventional pairing. We show that the sublattice interference mechanism is central to understanding the formation of superconductivity in a kagome metal.

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  • Large-gap quantum spin Hall insulators, which utilize Dirac fermions, are being explored for room-temperature applications, primarily due to their strong spin-orbit interaction.
  • A common method to create these materials involves using monolayers of heavy atoms on hexagonal templates; however, this often results in triangular lattices that usually do not support the desired properties.
  • The study introduces "indenene," a triangular monolayer of indium on SiC, which demonstrates unique valley physics and the quantum spin Hall phase despite its triangular structure, revealing underlying honeycomb characteristics through specific wave function behaviors.
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A current challenge in condensed matter physics is the realization of strongly correlated, viscous electron fluids. These fluids can be described by holography, that is, by mapping them onto a weakly curved gravitational theory via gauge/gravity duality. The canonical system considered for realizations has been graphene.

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  • The Rashba effect is key to understanding two-dimensional electron systems and is crucial for various spintronic applications.
  • This study provides strong experimental support for the idea that orbital angular momentum (OAM) in Bloch wave functions is responsible for the Rashba effect in a monolayer of AgTe on Ag(111).
  • By employing advanced techniques like angle-resolved photoemission (ARPES) and low-energy electron diffraction, researchers establish a clear link between OAM and Rashba spin splittings in AgTe's electronic bands.
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  • TaAs and TaP are recognized as Weyl semimetals, but understanding their surface features and Fermi arcs related to their bulk Weyl points has been a challenge.
  • * The study combines linear dichroism in angle-resolved photoemission with first-principles calculations to investigate the orbital texture on the Fermi surface of TaP(001).
  • * The researchers identify distinct changes in orbital texture at Weyl nodes, demonstrating the importance of orbital degrees of freedom in connecting surface and bulk properties in Weyl semimetals.*
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Controllable metal-insulator transitions (MIT), Rashba-Dresselhaus (RD) spin splitting, and Weyl semimetals are promising schemes for realizing processing devices. Complex oxides are a desirable materials platform for such devices, as they host delicate and tunable charge, spin, orbital, and lattice degrees of freedoms. Here, using first-principles calculations and symmetry analysis, we identify an electric-field tunable MIT, RD effect, and Weyl semimetal in a known, charge-ordered, and polar relativistic oxide AgBiO at room temperature.

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The electric and nonvolatile control of the spin texture in semiconductors would represent a fundamental step toward novel electronic devices combining memory and computing functionalities. Recently, GeTe has been theoretically proposed as the father compound of a new class of materials, namely ferroelectric Rashba semiconductors. They display bulk bands with giant Rashba-like splitting due to the inversion symmetry breaking arising from the ferroelectric polarization, thus allowing for the ferroelectric control of the spin.

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By combining bulk sensitive soft-x-ray angular-resolved photoemission spectroscopy and first-principles calculations we explored the bulk electron states of WTe_{2}, a candidate type-II Weyl semimetal featuring a large nonsaturating magnetoresistance. Despite the layered geometry suggesting a two-dimensional electronic structure, we directly observe a three-dimensional electronic dispersion. We report a band dispersion in the reciprocal direction perpendicular to the layers, implying that electrons can also travel coherently when crossing from one layer to the other.

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We show that, in the presence of a deformable lattice potential, the nature of the disorder-driven metal-insulator transition is fundamentally changed with respect to the noninteracting (Anderson) scenario. For strong disorder, even a modest electron-phonon interaction is found to dramatically renormalize the random potential, opening a mobility gap at the Fermi energy. This process, which reflects disorder-enhanced polaron formation, is here given a microscopic basis by treating the lattice deformations and Anderson localization effects on the same footing.

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Topological crystalline insulators are materials in which the crystalline symmetry leads to topologically protected surface states with a chiral spin texture, rendering them potential candidates for spintronics applications. Using scanning tunneling spectroscopy, we uncover the existence of one-dimensional (1D) midgap states at odd-atomic surface step edges of the three-dimensional topological crystalline insulator (Pb,Sn)Se. A minimal toy model and realistic tight-binding calculations identify them as spin-polarized flat bands connecting two Dirac points.

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Article Synopsis
  • The topological properties of lead-tin chalcogenide topological crystalline insulators can be adjusted through variations in temperature and composition.
  • Doping epitaxial Pb Sn Te (111) films with bulk Bi leads to significant Rashba splitting at the surface, which can be modified based on the level of doping.
  • Tight binding calculations suggest that this effect arises from the pinning of the Fermi level due to trap states present at the surface.
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A displacive-type mechanism, which accounts for the occurrence of ferroelectricity in most inorganic ferroelectrics, is rarely found in molecule-based ferroelectrics. Its role is often covered by the predominant order-disorder one. Herein, we report a lone-pair-electron-driven displacive-type ferroelectric organic-inorganic hybrid compound, [Hdmdap][SbCl] (1; dmdap = N,N-dimethyl-1,3-diaminopropane).

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  • The study uses density functional theory to explore how spin-orbit coupling affects a new class of materials called ABC hyperferroelectrics.
  • Findings reveal intricate relationships between ferroelectric properties and phenomena like the bulk Rashba effect and a three-dimensional topological insulator phase, including topological surface states in thin films.
  • The research also predicts that alloying can induce a topological transition to a Weyl semimetal phase that remains stable even with disorder, positioning hyperferroelectrics as potential candidates for advanced spin-orbitronic technologies.
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We report the synthesis, single crystal X-ray diffraction, and thermal, dielectric, Raman and infrared studies of a novel heterometallic formate [C2H5NH3][Na0.5Fe0.5(HCOO)3] (EtANaFe).

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Photoelectron spectroscopy in combination with piezoforce microscopy reveals that the helicity of Rashba bands is coupled to the nonvolatile ferroelectric polarization of GeTe(111). A novel surface Rashba band is found and fingerprints of a bulk Rashba band are identified by comparison with density functional theory calculations.

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Metal-organic frameworks (MOFs) are hybrid crystalline compounds comprised of an extended ordered network made up of organic molecules, organic linkers and metal cations. In particular, MOFs with the same topology as inorganic perovskites have been shown to possess interesting properties, e.g.

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By addressing the interplay between substitutional disorder and spin-orbit-coupling in chalcogenide alloys, we predict a strong robustness of spectral features at the Fermi energy. Indeed, supplementing our state of the art first-principles calculations with modeling analysis, we show that the disorder self-energy is vanishingly small close to the band gap, thus i) allowing for bulk Rashba-like spin splitting to be observed in ferroelectric alloys by means of Angle Resolved PhotoEmission Spectroscopy, and ii) protecting the band-character inversion related to the topological transition in recently discovered Topological Crystalline Insulators. Such a protection against strong disorder, which we demonstrate to be general for three dimensional Dirac systems, has potential and valuable implications for novel technologies, as spintronics and/or spinorbitronics.

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We study with first-principles methods the interplay between bulk and surface Dirac fermions in three dimensional Dirac semimetals. By combining density functional theory with the coherent potential approximation, we reveal a topological phase transition in Na_{3}Bi_{1-x}Sb_{x} and Cd_{3}[As_{1-x}P_{x}]_{2} alloys, where the material goes from a Dirac semimetal to a trivial insulator upon changing Sb or P concentrations. Tuning the composition allows us to engineer the position of the bulk Dirac points in reciprocal space.

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