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At least 253 records · Page 14
All sourcesNASA NTRSDOE OSTI
DOE OSTI2021

Origins of anisotropic transport in the electrically switchable antiferromagnet Fe 1/3 NbS 2

Recent experiments on the antiferromagnetic intercalated transition metal dichalcogenide Fe 1/3 NbS 2 have demonstrated reversible resistivity switching by application of orthogonal current pulses below its magnetic ordering temperature, making Fe 1/3 NbS 2 promising for spintronics applications. Here, we perform density functional theory calculations with Hubbard U corrections of the magnetic order, electronic structure, and transport properties of crystalline Fe 1/3 NbS 2 , clarifying the origin of the different resistance states. The two experimentally proposed antiferromagnetic ground states, corresponding to in-plane stripe and zigzag ordering, are computed to be nearly degenerate. In-plane cross sections of the calculated Fermi surfaces are anisotropic for both magnetic orderings, with the degree of anisotropy sensitive to the Hubbard U value. The in-plane resistance, computed within the Kubo linear response formalism using a constant relaxation time approximation, is also anisotropic, supporting a hypothesis that the current-induced resistance changes are due to a repopulating of antiferromagnetic domains. Our calculations indicate that the transport anisotropy of Fe 1/3 NbS 2 in the zigzag phase is reduced relative to stripe, consistent with the relative magnitudes of resistivity changes in experiment. Finally, our calculations reveal the likely directionality of the current-domain response, specifically, which domains are energetically stabilized for a given current direction.

36 MATERIALS SCIENCE↗
DOE OSTI2021

Collective excitations in the tetravalent lanthanide honeycomb antiferromagnet

Thermomagnetic and inelastic neutron-scattering measurements on Na 2 PrO 3 are reported. This material is an antiferromagnetic honeycomb magnet based on the tetravalent lanthanide Pr 4+ and has been proposed to host dominant antiferromagnetic Kitaev interactions. These measurements reveal magnetic fluctuations in Na 2 PrO 3 below an energy of 2 meV as well as crystal-field excitations around 230 meV. Furthermore, the latter energy is comparable to the scale of the spin-orbit interaction and explains both the very small effective moment of around 1.0μB per Pr 4+ and the difficulty to uncover any static magnetic scattering below the ordering transition at T N = 4.6 K. By comparing the low-energy magnetic excitations in Na 2 PrO 3 to those of the isostructural spin-only compound, Na 2 TbO 3 , a microscopic model of exchange interactions is developed that implicates dominant and surprisingly large Heisenberg exchange interactions J≈1.1(1) meV. Although antiferromagnetic Kitaev interactions with K≤0.2J cannot be excluded, the inelastic neutron-scattering data of Na 2 PrO 3 is best explained with a Δ=1.22 easy-axis XXZ exchange anisotropy.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2021

$A$-type antiferromagnetic order and magnetic phase diagram of the trigonal Eu spin-$\frac{7}{2}$ triangular-lattice compound $\mathrm{EuSn_2As_2}$

The trigonal compound EuSn 2 As 2 was recently discovered to host Dirac surface states within the bulk band gap and orders antiferromagnetically below the N´eel temperature T N = 23.5(2) K from neutron-diffraction measurements. Here the magnetic ground state of single-crystal EuSn 2 As 2 and the evolution of its properties versus temperature T and applied magnetic field H are reported. Included are the zero-field single-crystal neutron diffraction measurements versus T, magnetization M(H, T), magnetic susceptibility χ(H, T) = M(H,T)/H, heat capacity C p (H, T), and electrical resistivity ρ(H, T) measurements. The neutron-diffraction and χ(T) measurements both indicate a collinear A-type antiferromagnetic (AFM) structure below T N , where the Eu 2+ spins S = 7/2 in a triangular ab-plane layer (hexagonal unit cell) are aligned ferromagnetically in the ab plane whereas the spins in adjacent Eu planes along the c axis are aligned antiferromagnetically. The χ(H ab , T) and χ(Hc, T) data together indicate a smooth crossover between the collinear AFM alignment and an unknown magnetic structure at H ≈ 0.12 T. Dynamic spin fluctuations up to 60 K are evident in the χ(T), Cp(T) and ρ(H, T) measurements, a temperature that is more than twice T N . The ρ(H, T) is consistent with a low-carrier-density metal with strong magnetic scattering and does not reflect a contribution of the topological state of the material as reported earlier by ARPES measurements. This observation is consistent with previous ones for other topological insulators where the chemical potential is above the Dirac point so that ARPES readily detects the surface states, whereas resistivity measurements do not. Finally, the magnetic phase diagrams for both H ∥ c and H ∥ ab in the H-T plane are constructed from the T N (H), χ(H, T), Cp(H, T), and ρ(H, T) data.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2024

Electronic structure and magnetic and transport properties of antiferromagnetic Weyl semimetal GdAlSi

Here we report the topological electronic structure, magnetic, and magnetotransport properties of a noncentrosymmetric compound GdAlSi. Magnetic susceptibility shows an antiferromagnetic transition at TN = 32 K. In-plane isothermal magnetization exhibits an unusual hysteresis behavior at higher magnetic field, rather than near zero field. Moreover, the hysteresis behavior is asymmetric under positive and negative magnetic fields. First-principles calculations were performed on various magnetic configurations, revealing that the antiferromagnetic state is the ground state, and the spiral antiferromagnetic state is a close competing state. The calculations also reveal that GdAlSi hosts multiple Weyl points near the Fermi energy. The band structure measured by angle-resolved photoemission spectroscopy (ARPES) shows relatively good agreement with the theory, with the possibility of Weyl nodes slightly above the Fermi energy. Within the magnetic ordered state, we observe an exceptionally large anomalous Hall conductivity (AHC) of ~ 1310 Ω-1cm-1 at 2 K. Interestingly, the anomalous Hall effect persists up to room temperature with a significant value of AHC (~ 155 Ω-1cm-1). Our analysis indicates that the large AHC originates from the Berry curvature associated with the multiple pairs of Weyl points near Fermi energy.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2015

Strain dependence of antiferromagnetic interface coupling in La 0.7 Sr 0.3 MnO 3 /SrRuO 3 superlattices

We have investigated the magnetic response of La 0.7 Sr 0.3 MnO 3 /SrRuO 3 superlattices to biaxial in-plane strain applied in situ. Superlattices grown on piezoelectric substrates of 0.72PbMg 1/3 Nb 2/3 O 3 -0.28PbTiO 3 (001) (PMN-PT) show strong antiferromagnetic coupling of the two ferromagnetic components. The coupling field of mu H-0(AF) = 1.8 T is found to change by mu(0)Delta H-AF/Delta epsilon similar to -520 mT %(-1) under reversible biaxial strain Delta epsilon at 80 K in a [La 0.7 Sr 0.3 MnO 3 (22 angstrom)/SrRuO 3 (55 angstrom)] 15 superlattice. This reveals a significant strain effect on interfacial coupling. The applied in-plane compression enhances the ferromagnetic order in the manganite layers, which are under as-grown tensile strain, leading to a larger net coupling of SrRuO 3 layers at the interface. It is thus difficult to disentangle the contributions from strain-dependent antiferromagnetic Mn-O-Ru interface coupling and Mn-O-Mn ferromagnetic double exchange near the interface for the strength of the apparent antiferromagnetic coupling. We discuss our results in the framework of available models.

36 MATERIALS SCIENCE↗
DOE OSTI2015

Spin dynamics near a putative antiferromagnetic quantum critical point in Cu-substituted BaFe 2 As 2 and its relation to high-temperature superconductivity

We present the results of elastic and inelastic neutron scattering measurements on nonsuperconducting Ba(Fe 0.957 Cu 0.043 ) 2 As 2 , a composition close to a quantum critical point between antiferromagnetic (AFM) ordered and paramagnetic phases. By comparing these results with the spin fluctuations in the low-Cu composition as well as the parent compound BaFe 2 As 2 and superconducting Ba(Fe 1–x Ni x ) 2 As 2 compounds, we demonstrate that paramagnon-like spin fluctuations are evident in the antiferromagnetically ordered state of Ba(Fe 0.957 Cu 0.043 ) 2 As 2 , which is distinct from the AFM-like spin fluctuations in the superconducting compounds. Our observations suggest that Cu substitution decouples the interaction between quasiparticles and the spin fluctuations. In addition, we show that the spin-spin correlation length ξ(T) increases rapidly as the temperature is lowered and find ω/T scaling behavior, the hallmark of quantum criticality, at an antiferromagnetic quantum critical point.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2016

Structural and antiferromagnetic properties of Ba ( Fe 1 - x - y Co x Rh y ) 2 As 2 compounds

Here, we present a systematic investigation of the electrical, structural, and antiferromagnetic properties for the series of Ba(Fe 1-x-y CoxRh y ) 2 As 2 compounds with fixed x≈0.027 and 0≤y≤0.035. We compare our results for the Co-Rh doped Ba(Fe 1-x-y Co x Rh y ) 2 As 2 compounds with the Co doped Ba(Fe 1-x Co x ) 2 As 2 compounds. We demonstrate that the electrical, structural, antiferromagnetic, and superconducting properties of the Co-Rh doped compounds are similar to the properties of the Co doped compounds. We find that the overall behaviors of Ba(Fe 1-x-y Co x Rh y ) 2 As 2 and Ba(Fe 1-x Co x ) 2 As 2 compounds are very similar when the total number of extra electrons per Fe/TM (TM=transition metal) site is considered, which is consistent with the rigid band model. Despite the similarity, we find that the details of the transitions, for example, the temperature difference between the structural and antiferromagnetic transition temperatures and the incommensurability of the antiferromangetic peaks, are different between Ba(Fe 1-x-y Co x Rh y ) 2 As 2 and Ba(Fe 1-x Co x ) 2 As 2 compounds.

36 MATERIALS SCIENCE↗
DOE OSTI2016

Impurity-induced antiferromagnetic domains in the periodic Anderson model

A central feature of the periodic Anderson model is the competition between antiferromagnetism, mediated by the Ruderman-Kittel-Kasuya-Yosida interaction at small conduction electron-local electron hybridization V, and singlet formation at large V. At zero temperature, and in dimension d>1, these two phases are separated by a quantum critical point V c . We also use quantum Monte Carlo (QMC) simulations to explore the effect of impurities which have a local hybridization V* c in the antiferromagnetic regime which are embedded in a bulk singlet phase with V>V c . We then measure the suppression of singlet correlations and the antiferromagnetic correlations which form around the impurity, as well as the size of the resulting domain. Exact diagonalization calculations for linear chains allow us to verify that the qualitative features obtained at intermediate coupling and finite T persist to strong coupling and T=0, regimes which are difficult to access with QMC. Our calculations show an agreement qualitatively with NMR measurements in CeCoIn 5-x Cd x .

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2017

Unusual magnetic excitations in the weakly ordered spin- 1 2 chain antiferromagnet Sr 2 CuO 3 : Possible evidence for Goldstone magnon coupled with the amplitude mode

We report on an electron spin resonance (ESR) study of a nearly one-dimensional (1D) spin-1/2 chain antiferromagnet, Sr 2 CuO 3 , with extremely weak magnetic ordering. The ESR spectra at T > T N , in the disordered Luttinger-spin-liquid phase, reveal nearly ideal Heisenberg-chain behavior with only a very small, field-independent linewidth, ~1/T. In the ordered state, below T N , we identify field-dependent antiferromagnetic resonance modes, which are well described by pseudo-Goldstone magnons in the model of a collinear biaxial antiferromagnet. Additionally, we observe a major resonant mode with unusual and strongly anisotropic properties, which is not anticipated by the conventional theory of Goldstone spin waves. Lastly, we propose that this unexpected magnetic excitation can be attributed to a field-independent magnon mode renormalized due to its interaction with the high-energy amplitude (Higgs) mode in the regime of weak spontaneous symmetry breaking.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2017

Single-ion properties of the S eff = 1 2 XY antiferromagnetic pyrochlores Na A ' Co 2 F 7 ( A ' = Ca 2 + , Sr 2 + )

The antiferromagnetic pyrochlore material NaCaCo 2 F 7 is a thermal spin liquid over a broad temperature range (≈140 K down to T F =2.4 K), in which magnetic correlations between Co 2+ dipole moments explore a continuous manifold of antiferromagnetic XY states. The thermal spin liquid is interrupted by spin freezing at a temperature that is ~2% of the mean-field interaction strength, leading to short-range static XY clusters with distinctive relaxation dynamics. Here we report the low-energy inelastic neutron scattering response from the related compound NaSrCo 2 F 7 , confirming that it hosts the same static and dynamic spin correlations as NaCaCo 2 F 7 . We then present the single-ion levels of Co 2+ in these materials as measured by inelastic neutron scattering. An intermediate spin-orbit coupling model applied to an ensemble of trigonally distorted octahedral crystal fields accounts for the observed transitions. The single-ion ground state of Co 2+ is a Kramers doublet with a strongly XY-like g tensor ( gxy/gz ~3). The local disorder inherent from the mixed pyrochlore A sites (Na + /Ca 2+ and Na + /Sr 2+ ) is evident in these measurements as exaggerated broadening of some of the levels. A simple model that reproduces the salient features of the single-ion spectrum produces approximately 8.4% and 4.1% variation in the z and xy components of the g tensor, respectively. In conclusion, this study confirms that an S eff = 1/2 model with XY antiferromagnetic exchange and weak exchange disorder serves as a basic starting point in understanding the low-temperature magnetic behavior of these strongly frustrated magnets.

36 MATERIALS SCIENCE↗
DOE OSTI2017

Magnetic structure and dispersion relation of the S = 1 2 quasi-one-dimensional Ising-like antiferromagnet BaCo 2 V 2 O 8 in a transverse magnetic field

Here, BaCo 2 V 2 O 8 consists of Co chains in which a Co 2+ ion carries a fictitious spin 1/2 with Ising anisotropy. We performed elastic and inelastic neutron scattering experiments in BaCo 2 V 2 O 8 in a magnetic field perpendicular to the c axis which is the chain direction. With applying magnetic field along the a axis at 3.5 K, the antiferromagnetic order with the easy axis along the c axis, observed in zero magnetic field, is completely suppressed at 8 T, while the magnetic field gradually induces an antiferromagnetic order with the spin component along the b axis. We also studied magnetic excitations as a function of transverse magnetic field. The lower boundary of the spinon excitations splits gradually with increasing magnetic field. The overall feature of the magnetic excitation spectra in the magnetic field is reproduced by the theoretical calculation based on the spin 1/2 XXZ antiferromagnetic chain model, which predicts that the dynamic magnetic structure factor of the spin component along the chain direction is enhanced and that along the field direction has clear incommensurate correlations.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2017

Spin order and dynamics in the diamond-lattice Heisenberg antiferromagnets CuRh 2 O 4 and CoRh 2 O 4

Here, antiferromagnetic insulators on a diamond lattice are candidate materials to host exotic magnetic phenomena ranging from spin-orbital entanglement to degenerate spiral ground states and topological paramagnetism. Compared to other three-dimensional networks of magnetic ions, such as the geometrically frustrated pyrochlore lattice, the investigation of diamond-lattice magnetism in real materials is less mature. In this work, we characterize the magnetic properties of model A-site spinels CoRh 2 O 4 (cobalt rhodite) and CuRh 2 O 4 (copper rhodite) by means of thermomagnetic and neutron-scattering measurements, and we perform group theory analysis, Rietveld refinement, mean-field theory, and spin-wave theory calculations to analyze the experimental results. Our investigation reveals that cubic CoRh 2 O 4 is a canonical S = 3/2 diamond-lattice Heisenberg antiferromagnet with a nearest-neighbor exchange J = 0.63 meV and a Néel ordered ground state below a temperature of 25 K. In tetragonally distorted CuRh 2 O 4 , competing exchange interactions between up to third-nearest-neighbor spins lead to the development of an incommensurate spin helix at 24 K with a magnetic propagation vector k m = (0,0,0.79). Strong reduction of the ordered moment is observed for the S = 1/2 spins in CuRh 2 O 4 and captured by our 1/ S corrections to the staggered magnetization. Our work identifies CoRh 2 O 4 and CuRh 2 O 4 as reference materials to guide future work searching for exotic quantum behavior in diamond-lattice antiferromagnets.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2017

Suppression of the antiferromagnetic order when approaching the superconducting state in a phase-separated crystal of K x Fe 2 - y Se 2

Here, we combined elastic and inelastic neutron scattering techniques, magnetic susceptibility, and resistivity measurements to study single-crystal samples of K x Fe 2-y Se 2 , which contain the superconducting phase that has a transition temperature of ~31 K. In the inelastic neutron scattering measurements, we also observe both the spin-wave excitations resulting from the block antiferromagnetic ordered phase and the resonance that is associated with the superconductivity in the superconducting phase, demonstrating the coexistence of these two orders. From the temperature dependence of the intensity of the magnetic Bragg peaks, we find that well before entering the superconducting state, the development of the magnetic order is interrupted, at ~42 K. We consider this result to be evidence for the physical separation of the antiferromagnetic and superconducting phases; the suppression is possibly due to the proximity effect of the superconducting fluctuations on the antiferromagnetic order.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2019

Insights into the evolution from ferromagnetism to antiferromagnetism: A doping-dependent study of NaCrSi x Ge 2 - x O 6 ( 0 ≤ x ≤ 2 )

NaCrGe 2 O 6 and NaCrSi 2 O 6 are isostructural compounds exhibiting different magnetic ground states. NaCrGe2O6 adopts a ferromagnetic ground state with Tc=6K, whereas NaCrSi 2 O 6 orders antiferromagnetically below T N =3.4K. Although it has been proposed that the intriguing magnetic behavior in Cr-based pyroxenes involves competition between antiferromagnetic direct exchange and ferromagnetic superexchange interactions, a delicate balance that is sensitive to Cr-Cr distance and local distortion, no spectroscopy study has been done to determine the microscopic interactions in these compounds. To delve deeper into the evolution from ferromagnetism to antiferromagnetism, we performed a doping-dependent study to investigate how the substitution of Ge by Si affects the magnetic properties of NaCrSi x Ge 2-x O 6 (x=0, 0.5, 1, 1.5, 2). Neutron diffraction and magnetization measurements show that replacing larger Ge with smaller Si simultaneously suppresses the ferromagnetic order. The lattice constants and the unit-cell volume contract, i.e., chemical pressure effect, and the Cr-Cr distance within the chain gradually decreases with increasing Si doping. High-resolution inelastic neutron-scattering studies of the spin waves of NaCrGe 2 O 6 and NaCrSi 2 O 6 indicate that replacing Ge with Si has profound effect on the intrachain coupling, whereas it has negligible effect on the interchain couplings. We compare our results, which indicate NaCrGe 2 O 6 is magnetic quasi-one-dimensional (1D) and NaCrSi 2 O 6 is three-dimensional (3D), with LiCr(Si,Ge) 2 O 6 , where LiCrSi 2 O 6 is proposed to be magnetic quasi-1D and LiCrGe 2 O 6 is 3D, and discuss the different behaviors in magnetic dimensionality crossover in the context of how substituting Ge with Si fine-tunes the relative ratio between the intrachain and interchain couplings that defines the magnetic dimensionality in these materials.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2017

Itinerant Antiferromagnetism in RuO 2

Bulk rutile RuO 2 has long been considered a Pauli paramagnet. Here, in this article, we report that RuO 2 exhibits a hitherto undetected lattice distortion below approximately 900 K. The distortion is accompanied by antiferromagnetic order up to at least 300 K with a small room temperature magnetic moment of approximately 0.05μ B as evidenced by polarized neutron diffraction. Density functional theory plus U(DFT+U) calculations indicate that antiferromagnetism is favored even for small values of the Hubbard U of the order of 1 eV. The antiferromagnetism may be traced to a Fermi surface instability, lifting the band degeneracy imposed by the rutile crystal field. The combination of high Néel temperature and small itinerant moments make RuO 2 unique among ruthenate compounds and among oxide materials in general.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Observation of a C -type short-range antiferromagnetic order in layer spacing expanded FeS

Here, we report neutron diffraction studies of FeS single crystals obtained from Rb x Fe 2-y S 2 single crystals via a hydrothermal method. While no $\sqrt{5}$×$\sqrt{5}$ iron vacancy order or block antiferromagnetic order typical of Rb x Fe 2-y S 2 is found in our samples, we observe C-type short-range antiferromagnetic order with moments pointed along the c axis hosted by a different phase of FeS with an expanded interlayer spacing. The Néel temperature for this magnetic order is determined to be 170 ± 4 K. Our finding of a variant FeS structure hosting this C-type antiferromagnetic order demonstrates that the known FeS phase synthesized in this method is in the vicinity of a magnetically ordered ground state, providing insights into understanding a variety of phenomena observed in FeS and the related FeSe 1-x S x iron chalcogenide system.

36 MATERIALS SCIENCE↗
DOE OSTI2024

Exploring the impact of Cr-doping on the crystallographic and magnetic structure of Mn 5 Si 3 antiferromagnetic alloy

Here, the role of Cr-doping on the structural and magnetic ground states of Mn 5 Si 3 alloy has been investigated through temperature-dependent neutron powder diffraction (NPD) and X-ray absorption fine structure (XAFS) techniques. All the Cr-doped alloys of nominal composition Mn 5-x Cr x Si 3 (for x = 0.05, 0.1, and 0.2) undergo two first-order magneto-structural phase transitions from hexagonal (space group: P6 3 /mcm) paramagnetic → orthorhombic (space group: Ccmm) collinear antiferromagnetic → orthorhombic (space group: Cc2m) non-collinear antiferromagnetic phase on cooling from room temperature. NPD studies at different constant temperatures indicate that both anti ferromagnetic phases are commensurate in nature and can be represented by q = (0,1,0) magnetic propagation vector for all the Cr-doped alloys. Such doping at the Mn-site results in a significant modification of the non-collinear antiferromagnetic structure (both moment size and orientation) and hence affects the unusual magnetic properties, like inverted hysteresis loop, thermomagnetic irreversibility, etc. The XAFS measurements were performed to interpret the local environment of doped Cr atoms in detail, which is critical for a microscopic understanding of the unusual properties of this class of Cr-doped Mn 5 Si 3 alloys. The analysis confirms the elemental state of Cr in the doped alloys and indicates a high degree of preservation of local crystallographic structure with varying Cr concentration and sample temperature. Doping induces intriguing changes in XAFS patterns, elucidated through different types of scattering mechanisms associated with the central absorbing Cr atom.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2025

Revealing the electronic structure of van der Waals antiferromagnetic NiPS 3 through synchrotron-based 𝜇-ARPES and alkali metal dosing

Antiferromagnetic NiPS 3 has recently emerged as a quantum material of considerable interest, thanks to the discovery of multiple new couplings involving electrons, spins, orbitals, phonons, and magnons. However, controversies and open questions persist concerning the fundamental origins of these couplings. A critical piece of information required to advance the understanding is the precise electronic band structure of NiPS 3 . Angle-resolved photoemission spectroscopy (ARPES), combined with alkali metal dosing (AMD), can enable us to directly observe the subtle electronic states that appear around the Fermi surface, offering valuable insights into the intriguing quantum properties and interplays of the examined material. Here, in this study, we present a comprehensive characterization and analysis of the band structure of van der Waals layered antiferromagnet NiPS 3 , leveraging state-of-the-art μ-ARPES measurements supported by density functional theory (DFT) calculations. Theoretical DFT results identify the orbital contributions to the observed bands, providing a precise understanding of the experimental ARPES data. Crucially, AMD enables the observation of conduction band and defect-related states above the valence band maximum in NiPS 3 . Furthermore, temperature dependent ARPES results across the Néel transition temperature of NiPS 3 reveal that the paramagnetic and antiferromagnetic phases have nearly identical band structures, underlining the highly localized character of Ni d states. These findings substantially deepen our understanding of the electronic properties of NiPS 3 and lay a vital foundation for exploring the intriguing quantum phenomena it exhibits.

Cao, Yifeng [Boston Univ., MA (United States); Law↗