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result(s) for
"Band structure of solids"
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Direct observation of altermagnetic band splitting in CrSb thin films
by
Dunin-Borkowski, Rafal E.
,
Das, Suvadip
,
Reimers, Sonka
in
639/766/119/1001
,
639/766/119/995
,
Antiferromagnetism
2024
Altermagnetism represents an emergent collinear magnetic phase with compensated order and an unconventional alternating even-parity wave spin order in the non-relativistic band structure. We investigate directly this unconventional band splitting near the Fermi energy through spin-integrated soft X-ray angular resolved photoemission spectroscopy. The experimentally obtained angle-dependent photoemission intensity, acquired from epitaxial thin films of the predicted altermagnet CrSb, demonstrates robust agreement with the corresponding band structure calculations. In particular, we observe the distinctive splitting of an electronic band on a low-symmetry path in the Brilliouin zone that connects two points featuring symmetry-induced degeneracy. The measured large magnitude of the spin splitting of approximately 0.6 eV and the position of the band just below the Fermi energy underscores the significance of altermagnets for spintronics based on robust broken time reversal symmetry responses arising from exchange energy scales, akin to ferromagnets, while remaining insensitive to external magnetic fields and possessing THz dynamics, akin to antiferromagnets.
The fundamental hallmark of altermagnetism lies in the spin splitting of electronic valence bands. Here, the authors observe splitting in metallic CrSb, revealing an exceptionally large value and energetic placement just below the Fermi energy.
Journal Article
Flat bands in twisted bilayer transition metal dichalcogenides
by
Zhang, Zhiming
,
Taniguchi, Takashi
,
Tutuc, Emanuel
in
639/766/119/995
,
639/925/357/1018
,
Atomic
2020
The crystal structure of a material creates a periodic potential that electrons move through giving rise to its electronic band structure. When two-dimensional materials are stacked, the resulting moiré pattern introduces an additional periodicity so that the twist angle between the layers becomes an extra degree of freedom for the resulting heterostructure. As this angle changes, the electronic band structure is modified leading to the possibility of flat bands with localized states and enhanced electronic correlations
1
–
6
. In transition metal dichalcogenides, flat bands have been theoretically predicted to occur for long moiré wavelengths over a range of twist angles around 0° and 60° (ref.
4
) giving much wider versatility than magic-angle twisted bilayer graphene. Here, we show the existence of a flat band in the electronic structure of 3° and 57.5° twisted bilayer WSe
2
samples using scanning tunnelling spectroscopy. Our direct spatial mapping of wavefunctions at the flat-band energy show that the localization of the flat bands is different for 3° and 57.5°, in agreement with first-principles density functional theory calculations
4
.
Using scanning tunnelling spectroscopy, the flat bands in twisted bilayer WSe
2
are shown near both 0° and 60° twist angles.
Journal Article
Beyond Conventional Ferromagnetism and Antiferromagnetism: A Phase with Nonrelativistic Spin and Crystal Rotation Symmetry
by
Jungwirth, Tomas
,
Sinova, Jairo
,
Šmejkal, Libor
in
Anisotropy
,
Antiferromagnetism
,
Band structure of solids
2022
Recent series of theoretical and experimental reports have driven attention to time-reversal symmetry-breaking spintronic and spin-splitting phenomena in materials with collinear-compensated magnetic order incompatible with conventional ferromagnetism or antiferromagnetism. Here we employ an approach based on nonrelativistic spin-symmetry groups that resolves the conflicting notions of unconventional ferromagnetism or antiferromagnetism by delimiting a third basic collinear magnetic phase. We derive that all materials hosting this collinear-compensated magnetic phase are characterized by crystal-rotation symmetries connecting opposite-spin sublattices separated in the real space and opposite-spin electronic states separated in the momentum space. We describe prominent extraordinary characteristics of the phase, including the alternating spin-splitting sign and broken time-reversal symmetry in the nonrelativistic band structure, the planar or bulkd-,g-, ori-wave symmetry of the spin-dependent Fermi surfaces, spin-degenerate nodal lines and surfaces, band anisotropy of individual spin channels, and spin-split general, as well as time-reversal invariant momenta. Guided by the spin-symmetry principles, we discover in ab initio calculations outlier materials with an extraordinary nonrelativistic spin splitting, whose eV-scale and momentum dependence are determined by the crystal potential of the nonmagnetic phase. This spin-splitting mechanism is distinct from conventional relativistic spin-orbit coupling and ferromagnetic exchange, as well as from the previously considered anisotropic exchange mechanism in compensated magnets. Our results, combined with our identification of material candidates for the phase ranging from insulators and metals to a parent crystal of cuprate superconductors, underpin research of novel quantum phenomena and spintronic functionalities in high-temperature magnets with light elements, vanishing net magnetization, and strong spin coherence. In the discussion, we argue that the conflicting notions of unconventional ferromagnetism or antiferromagnetism, on the one hand, and our symmetry-based delimitation of the third phase, on the other hand, favor a distinct term referring to the phase. The alternating spin polarizations in both the real-space crystal structure and the momentum-space band structure characteristic of this unconventional magnetic phase suggest a term altermagnetism. We point out thatd-wave altermagnetism represents a realization of the long-sought-after counterpart in magnetism of the unconventionald-wave superconductivity.
Journal Article
Correlated states in twisted double bilayer graphene
2020
Electron–electron interactions play an important role in graphene and related systems and can induce exotic quantum states, especially in a stacked bilayer with a small twist angle
1
–
7
. For bilayer graphene where the two layers are twisted by the ‘magic angle’, flat band and strong many-body effects lead to correlated insulating states and superconductivity
4
–
7
. In contrast to monolayer graphene, the band structure of untwisted bilayer graphene can be further tuned by a displacement field
8
–
10
, providing an extra degree of freedom to control the flat band that should appear when two bilayers are stacked on top of each other. Here, we report the discovery and characterization of displacement field-tunable electronic phases in twisted double bilayer graphene. We observe insulating states at a half-filled conduction band in an intermediate range of displacement fields. Furthermore, the resistance gap in the correlated insulator increases with respect to the in-plane magnetic fields and we find that the
g
factor, according to the spin Zeeman effect, is ~2, indicating spin polarization at half-filling. These results establish twisted double bilayer graphene as an easily tunable platform for exploring quantum many-body states.
Placing two Bernal-stacked graphene bilayers on top of each other with a small twist angle gives correlated states. As the band structure can be tuned by an electric field, this platform is a more varied setting to study correlated electrons.
Journal Article
Observation of tunable band gap and anisotropic Dirac semimetal state in black phosphorus
by
Choi, Hyoung Joon
,
Baik, Seung Su
,
Sohn, Yeongsup
in
Anisotropy
,
Band structure of solids
,
Dispersion
2015
Black phosphorus consists of stacked layers of phosphorene, a two-dimensional semiconductor with promising device characteristics. We report the realization of a widely tunable band gap in few-layer black phosphorus doped with potassium using an in situ surface doping technique. Through band structure measurements and calculations, we demonstrate that a vertical electric field from dopants modulates the band gap, owing to the giant Stark effect, and tunes the material from a moderate-gap semiconductor to a band-inverted semimetal. At the critical field of this band inversion, the material becomes a Dirac semimetal with anisotropic dispersion, linear in armchair and quadratic in zigzag directions. The tunable band structure of black phosphorus may allow great flexibility in design and optimization of electronic and optoelectronic devices.
Journal Article
Local electronic structure variation resulting in Li ‘filament’ formation within solid electrolytes
2021
Solid electrolytes hold great promise for enabling the use of Li metal anodes. The main problem is that during cycling, Li can infiltrate along grain boundaries and cause short circuits, resulting in potentially catastrophic battery failure. At present, this phenomenon is not well understood. Here, through electron microscopy measurements on a representative system, Li
7
La
3
Zr
2
O
12
, we discover that Li infiltration in solid oxide electrolytes is strongly associated with local electronic band structure. About half of the Li
7
La
3
Zr
2
O
12
grain boundaries were found to have a reduced bandgap, around 1–3 eV, making them potential channels for leakage current. Instead of combining with electrons at the cathode, Li
+
ions are hence prematurely reduced by electrons at grain boundaries, forming local Li filaments. The eventual interconnection of these filaments results in a short circuit. Our discovery reveals that the grain-boundary electronic conductivity must be a primary concern for optimization in future solid-state battery design.
Solid electrolytes are promising for enabling the use of Li metal anodes but Li infiltration along grain boundaries can lead to battery failure. Li infiltration in a model solid oxide electrolyte is now found to be strongly associated with local electronic band structure.
Journal Article
Quantitative mappings between symmetry and topology in solids
by
Zhang, Tiantian
,
Fang, Chen
,
Fang, Zhong
in
639/301/119/995
,
639/766/119/2792/4128
,
Band structure
2018
The study of spatial symmetries was accomplished during the last century and had greatly improved our understanding of the properties of solids. Nowadays, the symmetry data of any crystal can be readily extracted from standard first-principles calculation. On the other hand, the topological data (topological invariants), the defining quantities of nontrivial topological states, are in general considerably difficult to obtain, and this difficulty has critically slowed down the search for topological materials. Here we provide explicit and exhaustive mappings from symmetry data to topological data for arbitrary gapped band structure in the presence of time-reversal symmetry and any one of the 230 space groups. The mappings are completed using the theoretical tools of layer construction and symmetry-based indicators. With these results, finding topological invariants in any given gapped band structure reduces to a simple search in the mapping tables provided.
The defining quantities of topological materials—the topological invariants—are often difficult to calculate. Here, Song et al. report a simplified method to calculate both the symmetry data and the topological invariants for arbitrary gapped band structure with time-reversal symmetry.
Journal Article
Observation of Fermi arc surface states in a topological metal
by
Shibayev, Pavel P.
,
Lin, Hsin
,
Neupane, Madhab
in
Aluminum
,
Band structure of solids
,
Chemical potential
2015
The topology of the electronic structure of a crystal is manifested in its surface states. Recently, a distinct topological state has been proposed in metals or semimetals whose spin-orbit band structure features three-dimensional Dirac quasiparticles. We used angle-resolved photoemission spectroscopy to experimentally observe a pair of spin-polarized Fermi arc surface states on the surface of the Dirac semimetal Na3Bi at its native chemical potential. Our systematic results collectively identify a topological phase in a gapless material. The observed Fermi arc surface states open research frontiers in fundamental physics and possibly in spintronics.
Journal Article
Failure of Nielsen-Ninomiya Theorem and Fragile Topology in Two-Dimensional Systems with Space-Time Inversion Symmetry: Application to Twisted Bilayer Graphene at Magic Angle
by
Park, Sungjoon
,
Ahn, Junyeong
,
Yang, Bohm-Jung
in
Band structure of solids
,
Bilayers
,
Classification
2019
We show that the Wannier obstruction and the fragile topology of the nearly flat bands in twisted bilayer graphene at magic angle are manifestations of the nontrivial topology of two-dimensional real wave functions characterized by the Euler class. To prove this, we examine the generic band topology of two-dimensional real fermions in systems with space-time inversionISTsymmetry. The Euler class is an integer topological invariant classifying real two-band systems. We show that a two-band system with a nonzero Euler class cannot have anIST-symmetric Wannier representation. Moreover, a two-band system with the Euler classe2has band crossing points whose total winding number is equal to2e2. Thus the conventional Nielsen-Ninomiya theorem fails in systems with a nonzero Euler class. We propose that the topological phase transition between two insulators carrying distinct Euler classes can be described in terms of the pair creation and annihilation of vortices accompanied by winding number changes across Dirac strings. When the number of bands is bigger than two, there is aZ2topological invariant classifying the band topology, that is, the second Stiefel Whitney class (w2). Two bands with an even (odd) Euler class turn into a system withw2=0(w2=1) when additional trivial bands are added. Although the nontrivial second Stiefel-Whitney class remains robust against adding trivial bands, it does not impose a Wannier obstruction when the number of bands is bigger than two. However, when the resulting multiband system with the nontrivial second Stiefel-Whitney class is supplemented by additional chiral symmetry, a nontrivial second-order topology and the associated corner charges are guaranteed.
Journal Article
Magnetism and charge density wave order in kagome FeGe
by
Hashimoto, Makoto
,
Rotenberg, Eli
,
Birgeneau, Robert J
in
Band structure of solids
,
Banded structure
,
Charge density waves
2023
Electron correlations often lead to emergent orders in quantum materials, and one example is the kagome lattice materials where topological states exist in the presence of strong correlations between electrons. This arises from the features of the electronic band structure that are associated with the kagome lattice geometry: flat bands induced by destructive interference of the electronic wavefunctions, topological Dirac crossings and a pair of van Hove singularities. Various correlated electronic phases have been discovered in kagome lattice materials, including magnetism, charge density waves, nematicity and superconductivity. Recently, a charge density wave was discovered in the magnetic kagome FeGe, providing a platform for understanding the interplay between charge order and magnetism in kagome materials. Here we observe all three electronic signatures of the kagome lattice in FeGe using angle-resolved photoemission spectroscopy. The presence of van Hove singularities near the Fermi level is driven by the underlying magnetic exchange splitting. Furthermore, we show spectral evidence for the charge density wave as gaps near the Fermi level. Our observations point to the magnetic interaction-driven band modification resulting in the formation of the charge density wave and indicate an intertwined connection between the emergent magnetism and charge order in this moderately correlated kagome metal.The observation of band structure features typical of the kagome lattice in FeGe suggests that an interplay of magnetism and electronic correlations determines the physics of this material.
Journal Article