I15-Extreme Conditions
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A. L. J.
Pereira
,
J. A.
Sans
,
O.
Gomis
,
D.
Santamaria-Perez
,
S.
Ray
,
A.
Godoy
,
A. S.
Da Silva-Sobrinho
,
P.
Rodríguez-Hernández
,
A.
Muñoz
,
C.
Popescu
,
F. J.
Manjon
Diamond Proposal Number(s):
[6073]
Open Access
Abstract: We report a joint experimental and theoretical study of the structural and vibrational properties of C-type bulk Y2O3 under hydrostatic compression. The combination of high-pressure X-ray diffraction and Raman scattering experimental measurements with ab initio theoretical calculations on bulk Y2O3 allows us to confirm the cubic (C-type) - monoclinic (B-type) - trigonal (A-type) phase transition sequence on the upstroke and the trigonal-monoclinic phase transition on the downstroke. This result reconciles with the results already found in related rare-earth sesquioxides of cations with similar ionic radii as Y, such as Ho2O3 and Dy2O3, and ends with the controversy regarding the existence of the intermediate monoclinic phase between the cubic and trigonal phases in pure bulk Y2O3 on the upstroke. As a byproduct, the good agreement between experimental and calculated results allows us to use extensive theoretical data to discuss the structural and vibrational behavior of the three phases of Y2O3 under compression, thus allowing a more detailed understanding of the effect of pressure on rare-earth sesquioxides than previous studies.
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May 2023
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I05-ARPES
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A. Garrison
Linn
,
Peipei
Hao
,
Kyle N.
Gordon
,
Dushyant
Narayan
,
Bryan S.
Berggren
,
Nathaniel
Speiser
,
Sonka
Reimers
,
Richard P.
Campion
,
Vít
Novák
,
Sarnjeet S.
Dhesi
,
Timur K.
Kim
,
Cephise
Cacho
,
Libor
Šmejkal
,
Tomáš
Jungwirth
,
Jonathan D.
Denlinger
,
Peter
Wadley
,
Daniel S.
Dessau
Diamond Proposal Number(s):
[24224]
Open Access
Abstract: Tetragonal CuMnAs is a room temperature antiferromagnet with an electrically reorientable Néel vector and a Dirac semimetal candidate. Direct measurements of the electronic structure of single-crystalline thin films of tetragonal CuMnAs using angle-resolved photoemission spectroscopy (ARPES) are reported, including Fermi surfaces (FS) and energy-wavevector dispersions. After correcting for a chemical potential shift of ≈− 390 meV (hole doping), there is excellent agreement of FS, orbital character of bands, and Fermi velocities between the experiment and density functional theory calculations. In addition, 2×1 surface reconstructions are found in the low energy electron diffraction (LEED) and ARPES. This work underscores the need to control the chemical potential in tetragonal CuMnAs to enable the exploration and exploitation of the Dirac fermions with tunable masses, which are predicted to be above the chemical potential in the present samples.
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May 2023
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I05-ARPES
|
Diamond Proposal Number(s):
[20573, 28919, 32737]
Open Access
Abstract: Diverse emergent correlated electron phenomena have been observed in twisted-graphene layers. Many electronic structure predictions have been reported exploring this new field, but with few momentum-resolved electronic structure measurements to test them. We use angle-resolved photoemission spectroscopy to study the twist-dependent (1° < θ < 8°) band structure of twisted-bilayer, monolayer-on-bilayer, and double-bilayer graphene (tDBG). Direct comparison is made between experiment and theory, using a hybrid k·p model for interlayer coupling. Quantitative agreement is found across twist angles, stacking geometries, and back-gate voltages, validating the models and revealing field-induced gaps in twisted graphenes. However, for tDBG at θ = 1.5 ± 0.2°, close to the magic angle θ = 1.3°, a flat band is found near the Fermi level with measured bandwidth Ew = 31 ± 5 meV. An analysis of the gap between the flat band and the next valence band shows deviations between experiment (Δh = 46 ± 5 meV) and theory (Δh = 5 meV), indicative of lattice relaxation in this regime.
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May 2023
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I05-ARPES
|
Abstract: In recent years, chromium sulphur bromide (CrSBr) has emerged as a promising highly- anisotropic semiconducting two-dimensional (2D) magnetic material to explore spintronics and quantum transport due to its strongly correlated quasiparticle interactions [1]. CrSBr is an A-type layered antiferromagnet; in the bulk material, above the Néel temperature (TN = 132K) it transitions to an intermediate ferromagnetic phase before becoming paramagnetic at high temperature. Experimental work on its fascinating optoelectronic properties has been heavily supported by electronic structure calculations using a variety of methods [2,3], but direct band structure measurements to test these predictions are still lacking. Recent angle- resolved photoemission microscopy (ARPES) measurements of bulk CrSBr were unable to measure below TN due to charging effects [4]. Here, we overcome this limitation through exfoliation of CrSBr flakes onto a template-stripped gold surface (Figure 1a) [5]. Using the nanoARPES endstation of the i05 beamline at Diamond Light Source, ARPES was acquired without charging from thin flakes (~10 nm thick) at temperatures down to < 40 K. Photon energy, and polarisation, dependent measurements confirm a strongly 2D dispersion and link the band dispersions to different atomic orbitals. Temperature-dependent measurements highlight electronic structure changes through the magnetic phase transitions, including shifts of the low energy valence bands and band splitting suggestive of spin-ordering (Figure 1b,c). These results also demonstrate a simple approach for the measurement of the low- temperature band structure of insulating layered materials.
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May 2023
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I21-Resonant Inelastic X-ray Scattering (RIXS)
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Andrea
Amorese
,
Philipp
Hansmann
,
Andrea
Marino
,
Peter
Körner
,
Thomas
Willers
,
Andrew
Walters
,
Ke-Jin
Zhou
,
Kurt
Kummer
,
Nicholas B.
Brookes
,
Hong-Ji
Lin
,
Chien-Te
Chen
,
Pascal
Lejay
,
Maurits W.
Haverkort
,
Liu Hao
Tjeng
,
Andrea
Severing
Diamond Proposal Number(s):
[18447]
Open Access
Abstract: We investigated the electronic structure of the enigmatic
CeRh
3
B
2
using resonant inelastic scattering and x-ray absorption spectroscopy in combination with ab initio density functional calculations. We find that the
Rh
4
d
states are irrelevant for the high-temperature ferromagnetism and the Kondo effect. We also find that the
Ce
4
f
crystal-field strength is too small to explain the strong reduction of the Ce magnetic moment. The data revealed instead the presence of two different active
Ce
4
f
orbitals, with each coupling selectively to different bands in
CeRh
3
B
2
. The intersite hybridization of the
∣
∣
J
=
5
2
,
J
z
=
±
1
2
⟩
crystal-field state and
Ce
5
d
band combined with the intrasite
Ce
4
f
–
5
d
exchange creates the strong ferromagnetism, while hybridization between the
∣
∣
J
=
5
2
,
J
z
=
±
5
2
⟩
and the B
s
p
in the
a
b
-plane contributes to the Kondo interaction, which causes the moment reduction. This orbital selective coupling explains the unique and seemingly contradictory properties of
CeRh
3
B
2
.
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Mar 2023
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I09-Surface and Interface Structural Analysis
|
Diamond Proposal Number(s):
[24219, 31681]
Abstract: Wide bandgap oxide semiconductors have gained significant attention in the fields from flat panel displays to solar cells, but their uses have been limited by the lack of high mobility p-type oxide semiconductors. Recently, β-phase TeO2 has been identified as a promising p-type oxide semiconductor with exceptional device performance. In this Letter, we report on the electronic structure of β-TeO2 studied by a combination of high-resolution x-ray spectroscopy and hybrid density functional theory calculations. The bulk bandgap of β-TeO2 is determined to be 3.7 eV. Direct comparisons between experimental and computational results demonstrate that the top of a valence band (VB) of β-TeO2 is composed of the hybridized Te 5s, Te 5p, and O 2p states, whereas a conduction band (CB) is dominated by unoccupied Te 5p states. The hybridization between spatially dispersive Te 5s2 states and O 2p orbitals helps us to alleviate the strong localization in the VB, leading to small hole effective mass and high hole mobility in β-TeO2. The Te 5p states provide stabilizing effect to the hybridized Te 5s-O 2p states, which is enabled by structural distortions of a β-TeO2 lattice. The multiple advantages of large bandgap, high hole mobility, two-dimensional structure, and excellent stability make β-TeO2 a highly competitive material for next-generation opto-electronic devices.
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Mar 2023
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I05-ARPES
|
Q. Q.
Zhang
,
Y.
Shi
,
K. Y.
Zhai
,
W. X.
Zhao
,
X.
Du
,
J. S.
Zhou
,
X.
Gu
,
R. Z.
Xu
,
Y. D.
Li
,
Y. F.
Guo
,
Z. K.
Liu
,
C.
Chen
,
S.-K.
Mo
,
T. K.
Kim
,
C.
Cacho
,
J. W.
Yu
,
W.
Li
,
Y. L.
Chen
,
J.-H.
Chu
,
L. X.
Yang
Diamond Proposal Number(s):
[22375]
Abstract: EuTe
4
is a van der Waals material exhibiting a charge density wave (CDW) with a large thermal hysteresis in the resistivity and CDW gap. In this paper, we systematically study the electronic structure and transport properties of
EuTe
4
using high-resolution angle-resolved photoemission spectroscopy (ARPES), magnetoresistance (MR) measurements, and scanning tunneling microscopy (STM). We observe a CDW gap of
∼
200
meV
at low temperatures that persists up to 400 K, suggesting that the CDW transition occurs at a much higher temperature. The ARPES intensity near the Fermi level shows large thermal hysteretic behavior, consistent with the resistivity measurement. The hysteresis in the resistivity measurement does not change under a magnetic field up to 7 T, excluding the thermal magnetic hysteretic effect. Instead, the surface topography measured with STM shows surface domains with different CDW trimerization directions, which may be important for the thermal hysteretic behavior. Interestingly, we reveal a large negative MR at low temperatures that can be associated with the canting of magnetically ordered Eu spins. Our results shed light on the understanding of magnetic, transport, and electronic properties of
EuTe
4
.
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Mar 2023
|
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I05-ARPES
|
Edgar
Abarca Morales
,
Gesa-R.
Siemann
,
Andela
Zivanovic
,
Philip A. E.
Murgatroyd
,
Igor
Markovic
,
Brendan
Edwards
,
Chris A.
Hooley
,
Dmitry A.
Sokolov
,
Naoki
Kikugawa
,
Cephise
Cacho
,
Matthew D.
Watson
,
Timur K.
Kim
,
Clifford W.
Hicks
,
Andrew P.
Mackenzie
,
Phil D. C.
King
Diamond Proposal Number(s):
[27471, 28412]
Abstract: We report the evolution of the electronic structure at the surface of the layered perovskite
Sr
2
RuO
4
under large in-plane uniaxial compression, leading to anisotropic
B
1
g
strains of
ϵ
x
x
−
ϵ
y
y
=
−
0.9
±
0.1
%
. From angle-resolved photoemission, we show how this drives a sequence of Lifshitz transitions, reshaping the low-energy electronic structure and the rich spectrum of van Hove singularities that the surface layer of
Sr
2
RuO
4
hosts. From comparison to tight-binding modeling, we find that the strain is accommodated predominantly by bond-length changes rather than modifications of octahedral tilt and rotation angles. Our study sheds new light on the nature of structural distortions at oxide surfaces, and how targeted control of these can be used to tune density of state singularities to the Fermi level, in turn paving the way to the possible realization of rich collective states at the
Sr
2
RuO
4
surface.
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Feb 2023
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I10-Beamline for Advanced Dichroism
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Xiaodong
Xie
,
Kejing
Ran
,
Yizhou
Liu
,
Raymond
Fan
,
Wancong
Tan
,
Haonan
Jin
,
Manuel
Valvidares
,
Nicolas
Jaouen
,
Haifeng
Du
,
Gerrit
Van Der Laan
,
Thorsten
Hesjedal
,
Shilei
Zhang
Diamond Proposal Number(s):
[20437, 26148, 22629]
Abstract: We identify a three-dimensional skyrmion side-face state in chiral magnets that consists of a thin layer of modulated surface spirals and an array of phase-locked skyrmion screws. Such chiral spin structures lead to a characteristic X-shaped magnetic diffraction pattern in resonant elastic x-ray scattering, reminiscent of Photo 51 of the DNA double-helix diffraction. By measuring both thin plates and bulk
Cu
2
OSeO
3
crystals in the field-in-plane geometry, we unambiguously identify the modulated skyrmion strings by retrieving their chirality and helix angle. The breaking of the translational symmetry along the side faces suppresses the bulk-favored conical state, providing a stabilization mechanism for the skyrmion lattice phase that has been overlooked so far.
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Feb 2023
|
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I05-ARPES
|
Hongwei
Fang
,
Meng
Lyu
,
Hao
Su
,
Jian
Yuan
,
Yiwei
Li
,
Lixuan
Xu
,
Shuai
Liu
,
Liyang
Wei
,
Xinqi
Liu
,
Haifeng
Yang
,
Qi
Yao
,
Meixiao
Wang
,
Yanfeng
Guo
,
Wujun
Shi
,
Yulin
Chen
,
Enke
Liu
,
Zhongkai
Liu
Abstract: The kagome-lattice crystal hosts various intriguing properties including the frustrated magnetism, charge order, topological state, superconductivity and correlated phenomena. To achieve high-performance kagome-lattice compounds for electronic and spintronic applications, careful tuning of the band structure would be desired. Here, the electronic structures of kagome-lattice crystal Ni3In2S2 were investigated by transport measurements, angle-resolved photoemission spectroscopy as well as ab initio calculations. The transport measurements reveal Ni3In2S2 as a compensated semimetal with record-high carrier mobility (∼8683 and 7356 cm2 V−1 S−1 for holes and electrons) and extreme magnetoresistance (15,518% at 2 K and 13 T) among kagome-lattice materials. These extraordinary properties are well explained by its band structure with indirect gap, small electron/hole pockets and large bandwidth of the 3d electrons of Ni on the kagome lattice. This work demonstrates that the crystal field and doping serve as the key tuning knobs to optimize the transport properties in kagome-lattice crystals. Our work provides material basis and optimization routes for kagome-lattice semimetals towards electronics and spintronics applications.
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Feb 2023
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