arXiv subjects

Z. K. Liu

Publications and source records attributed to Z. K. Liu.

At least 19 recordsLinked to original sources

arXiv2025

Dichotomy in Low- and High-energy Band Renormalizations in Trilayer Nickelate $La_{4}Ni_{3}O_{10}$: a Comparison with Cuprates

Band renormalizations comprise crucial insights for understanding the intricate roles of electron-boson coupling and electron correlation in emergent phenomena such as superconductivity. In this study, by combining high-resolution angle-resolved photoemission spectroscopy and theoretical calculations, we systematically investigate the electronic structure of the trilayer nickelate superconductor $La_{4}Ni_{3}O_{10}$ at ambient pressure. We reveal a dichotomy in the electronic band renormalizations of $La_{4}Ni_{3}O_{10}$ in comparison to cuprate superconductors. At a high energy scale of hundreds of meV, its band structure is strongly renormalized by electron correlation effect enhanced by Hund coupling. The resultant waterfall-like dispersions resemble the high-energy kinks in cuprate superconductors. However, at low energy scales of tens of meV, the dispersive bands are nearly featureless and devoid of any resolvable electron-boson interactions, in drastic contrast to the low-energy kinks observed in cuprates and other correlated 3d transition-metal compounds. The dichotomic band renormalizations highlight the disparity between nickelate and cuprate superconductors and emphasize the importance of strong electron-correlation in the superconductivity of Ruddlesden-Popper phase nickelates.

cond-mat.str-el↗

arXiv2025

Weyl Fermion Manipulation through Magnetic Transitions in the Ferromagnetic Non-Centrosymmetric Weyl semimetal PrAlSi

PrAlSi, a non-centrosymmetric ferromagnetic Weyl semimetal candidate with a Curie temperature of 17.8K, offers a unique platform for exploring the interplay of symmetry breaking and topological electronic structures. Up to now, the Weyl fermion distribution as well as their evolution across the ferromagnetic to paramagnetic phase transition in PrAlSi has not been explored. Here, we uncover the presence of Weyl fermions in PrAlSi and demonstrate they could be manipulated through the magnetic phase transition. Our ab-initio calculations indicate a shift in the momentum and energy positions of Weyl fermions, alongside an increase in Weyl point numbers due to band splitting. The predicted band splitting and shifting of Weyl fermions are corroborated by our angle-resolved photoemission spectroscopy experiments. Such manipulation of Weyl fermions leads to the appearance of a net chirality charge and a significant modulation in optical conductivity, as proposed by our calculations. Our research presents a novel method for adjusting the properties of Weyl semimetals by controlling Weyl fermions through magnetic phase transitions, positioning PrAlSi as a model system.

cond-mat.mtrl-sci↗

arXiv2025

Thermal conductivity and thermal diffusivity of molten salts: insights from molecular dynamics simulations and fundamental bounds

We use extensive molecular dynamics simulations to calculate thermal conductivity and thermal diffusivity in two common molten salts, LiF and KCl. Our analysis includes the total thermal conductivity and intrinsic conductivity involving mass currents measured experimentally. The latter shows good agreement with the experimental data. We also calculate their key thermodynamic properties such as constant-pressure and constant-volume specific heats. We subsequently compare the results to the lower bound for thermal diffusivity expressed in terms of fundamental physical constants. Using this comparison and recent theoretical insights into thermodynamic and transport properties in liquids, we interpret thermal properties on the basis of atomistic dynamics and phonon excitations. We finally find that thermal diffusivity of molten salts is close to their kinematic viscosity.

cond-mat.soft↗

arXiv2024

Thickness-dependent Topological Phases and Flat Bands in Rhombohedral Multilayer Graphene

Rhombohedral multilayer graphene has emerged as an extraordinary platform for investigating exotic quantum states, such as superconductivity and fractional quantum anomalous Hall effects, mainly due to the existence of topological surface flatbands. Despite extensive research efforts, a systematic spectroscopic investigation on the evolution of its electronic structure from thin layers to bulk remains elusive. Using state-of-the-art angle-resolved photoemission spectroscopy with submicron spatial resolution, we directly probe and trace the thickness evolution of the topological electronic structures of rhombohedral multilayer graphene. As the layer number increases, the gapped subbands transform into the 3D Dirac nodes that spirals in the momentum space; while the flatbands are constantly observed around Fermi level, and eventually evolve into the topological drumhead surface states. This unique thickness-dependent topological phase transition can be well captured by the 3D generalization of 1D Su-Schrieffer-Heeger chain in thin layers, to the topological Dirac nodal spiral semimetal in the bulk limit. Our findings establish a solid foundation for exploring the exotic quantum phases with nontrivial topology and correlation effects in rhombohedral multilayer graphene.

cond-mat.mes-hall↗

arXiv2024

Discovery of an Antiferromagnetic Topological Nodal-line Kondo Semimetal

The symbiosis of strong interactions, flat bands, topology and symmetry has led to the discovery of exotic phases of matter, including fractional Chern insulators, correlated moiré topological superconductors, and Dirac and Weyl semimetals. Correlated metals, such as those present in Kondo lattices, rely on the screening of local moments by a sea of non-magnetic conduction electrons. Here, we report on a unique topological Kondo lattice compound, CeCo2P2, where the Kondo effect - whose existence under the magnetic Co phase is protected by PT symmetry - coexists with antiferromagnetic order emerging from the flat bands associated with the Co atoms. Remarkably, this is the only known Kondo lattice compound where magnetic order occurs in non-heavy electrons, and puzzlingly, at a temperature significantly higher than that of the Kondo effect. Furthermore, at low temperatures, the emergence of the Kondo effect, in conjunction with a glide-mirror-z symmetry, results in a nodal line protected by bulk topology near the Fermi energy. These unusual properties, arising from the interplay between itinerant and correlated electrons from different constituent elements, lead to novel quantum phases beyond the celebrated topological Kondo insulators and Weyl Kondo semimetals. CeCo2P2 thus provides an ideal platform for investigating narrow bands, topology, magnetism, and the Kondo effect in strongly correlated electron systems.

cond-mat.str-el↗

arXiv2024

Topological Phase Transition in Quasi-One-Dimensional Bismuth Iodide Bi4I4

The exploration of topological quantum materials and topological phase transitions is at the forefront of modern condensed matter physics. Quasi-one-dimensional (quasi-1D) bismuth iodide Bi4I4 exhibits versatile topological phases of matter including weak topological insulator (WTI) and higher-order topological insulator (HOTI) phases with high tunability in response to external parameters. In this work, performing laser-based angle-resolved photoemission spectroscopy with submicron spatial resolution (micro-ARPES), we comprehensively investigate the fine electronic structure and topological phase transition of Bi4I4. Our examination of the low-temperature α-phase reveals the presence of an energy gap on the (100) surface, providing spectroscopic evidence for the HOTI phase. Conversely, the high-temperature β-Bi4I4 harbors a gapless Dirac fermion on the (100) surface alongside gapped states on the (001) surface, thereby establishing a WTI phase. By tracking the temperature evolution of the (100) surface states, we unveil a thermal hysteresis of the surface gap in line with the α-β structural phase transition. Our findings elucidate the topological properties of Bi4I4 and directly evidence a temperature-induced topological phase transition from WTI to HOTI, which paves the way to potential applications based on the room-temperature topological phase transition in the quasi-1D topological quantum material.

cond-mat.mtrl-sci↗

arXiv2024

Correlated Electronic Structure and Density-Wave Gap in Trilayer Nickelate La4Ni3O10

The discovery of pressurized superconductivity at 80 K in La3Ni2O7 officially brings nickelates into the family of high-temperature superconductors, which gives rise to not only new insights but also mysteries in the strongly correlated superconductivity. More recently, the sibling compound La4Ni3O10 was also shown to be superconducting below about 25 K under pressure, further boosting the popularity of nickelates in the Ruddlesden-Popper phase. In this study, combining high-resolution angle-resolved photoemission spectroscopy and ab initio calculation, we systematically investigate the electronic structures of La4Ni3O10 at ambient pressure. We reveal a high resemblance of La4Ni3O10 with La3Ni2O7 in the orbital-dependent fermiology and electronic structure, suggesting a similar electronic correlation between the two compounds. The temperature-dependent measurements imply an orbital-dependent energy gap related to the density-wave transition in La4Ni3O10. By comparing the theoretical pressure-dependent electronic structure, clues about the superconducting high-pressure phase can be deduced from the ambient measurements, providing crucial information for deciphering the unconventional superconductivity in nickelates.

cond-mat.supr-con↗

arXiv2024

Viscosity bounds in liquids with different structure and bonding types

Recently, it was realised that liquid viscosity has a lower bound which is nearly constant for all liquids and is governed by fundamental physical constants. This was supported by experimental data in noble and molecular liquids. Here, we perform large-scale molecular dynamics simulations to ascertain this bound in two other important liquid types: the ionic molten salt system LiF and metallic Pb. We find that these ionic and metallic systems similarly have lower viscosity bounds corresponding to the minimum of kinematic viscosity of about 10$^{-7}$ $\frac{{\rm m}^2}{\rm s}$. We show that this agrees with experimental data in other systems with different structures and bonding types, including noble, molecular, metallic and covalent liquids. This expands the universality of viscosity bounds into the main system types known.

cond-mat.soft↗

arXiv2023

Topological electronic structure and spin texture of quasi-one-dimensional higher-order topological insulator Bi4Br4

The notion of topological insulators (TIs), characterized by an insulating bulk and conducting topological surface states, can be extended to higher-order topological insulators (HOTIs) hosting gapless modes localized at the boundaries of two or more dimensions lower than the insulating bulk1-5. In this work, by performing high-resolution angle-resolved photoemission spectroscopy (ARPES) measurements with submicron spatial and spin resolutions, we systematically investigate the electronic structure and spin texture of quasi-one-dimensional (1D) HOTI candidate Bi4Br4. In contrast to the bulk-state-dominant spectra on the (001) surface, we observe gapped surface states on the (100) surface, whose dispersion and spin-polarization agree well with our ab initio calculations. Moreover, we reveal in-gap states connecting the surface valence and conduction bands, which is an explicit signature of the existence of hinge states inside the (100) surface gap. Our findings provide compelling evidence for the HOTI phase of Bi4Br4. The identification of the higher-order topological phase will lay the promising prospect of applications based on 1D spin-momentum locked current in electronic and spintronic devices.

cond-mat.mtrl-sci↗

arXiv2023

Orbital-selective charge-density wave in TaTe$_4$

TaTe$_4$, a metallic charge-density wave (CDW) material discovered decades ago, has attracted renewed attention due to its rich interesting properties such as pressure-induced superconductivity and candidate non-trivial topological phase. Here, using high-resolution angle-resolved photoemission spectroscopy and ab-initio calculation, we systematically investigate the electronic structure of TaTe$_4$. At 26 K, we observe a CDW gap as large as 290 meV, which persists up to 500 K. The CDW-modulated band structure shows a complex reconstruction that closely correlates with the lattice distortion. Inside the CDW gap, there exist highly dispersive energy bands contributing to the remnant Fermi surface and metallic behavior in the CDW state. Interestingly, our ab-initio calculation reveals that the large CDW gap mainly opens in the electronic states with out-of-plane orbital components, while the in-gap metallic states originate from in-plane orbitals, suggesting an orbital texture that couples with the CDW order. Our results shed light on the interplay between electron, lattice, and orbital in quasi-one-dimensional CDW materials.

cond-mat.str-el↗

arXiv2023

Genomic Materials Design: CALculation of PHAse Dynamics

The CALPHAD system of fundamental phase-level databases, now known as the Materials Genome, has enabled a mature technology of computational materials design and qualification that has already met the acceleration goals of the national Materials Genome Initiative. As first commercialized by QuesTek Innovations, the methodology combines efficient genomic-level parametric design of new material composition and process specifications with multidisciplinary simulation-based forecasting of manufacturing variation, integrating efficient uncertainty management. Recent projects demonstrated under the multi-institutional CHiMaD Design Center notably include novel alloys designed specifically for the new technology of additive manufacturing. With the proven success of the CALPHAD-based Materials Genome technology, current university research emphasizes new methodologies for affordable accelerated expansion of more accurate CALPHAD databases. Rapid adoption of these new capabilities by US apex corporations has compressed the materials design and development cycle to under 2 years, enabling a new "materials concurrency" integrated into a new level of concurrent engineering supporting an unprecedented level of manufacturing innovation.

cond-mat.mtrl-sci↗

arXiv2023

Thermal hysteretic behavior and negative magnetoresistance in an unusual charge-density-wave material EuTe4

EuTe4 is a newly-discovered van der Waals material exhibiting a novel charge-density wave (CDW) with a large thermal hysteresis in the resistivity and CDW gap. In this work, we systematically study the electronic structure and transport properties of EuTe4 using high-resolution angle-resolved photoemission spectroscopy (ARPES), magnetoresistance measurements, and scanning tunneling microscopy (STM). We observe a CDW gap of about 200 meV at low temperatures that persists up to 400 K, suggesting that the CDW transition occurs at a much higher temperature. We observe a large thermal hysteretic behavior of the ARPES intensity near the Fermi level, 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 hysteresis mechanism. Instead, the surface topography measured with STM shows surface domains with different CDW trimerization directions, which may be important for the thermal hysteretic behavior of EuTe4. Interestingly, we observe a large negative magnetoresistance at low temperatures that can be associated with the canting of magnetically ordered Eu spins. Our work shed light on the understanding of magnetic, transport, and electronic properties of EuTe4.

cond-mat.str-el↗

arXiv2023

Development of a Laser-based angle-resolved-photoemission spectrometer with sub-micrometer spatial resolution and high-efficiency spin detection

Angle-resolved photoemission spectroscopy with sub-micrometer spatial resolution (μ-ARPES), has become a powerful tool for studying quantum materials. To achieve sub-micrometer or even nanometer-scale spatial resolution, it is important to focus the incident light beam (usually from the synchrotron radiation) using X-ray optics such as the zone plate or ellipsoidal capillary mirrors. Recently, we developed a laser-based μ-ARPES with spin-resolution (LMS-ARPES). The 177 nm laser beam is achieved by frequency doubling a 355 nm beam using a KBBF crystal and subsequently focused using an optical lens with a focal length of about 16 mm. By characterizing the focused spot size using different methods and performing spatial-scanning photoemission measurement, we confirm the sub-micron spatial resolution of the system. Compared with the μ-ARPES facilities based on synchrotron radiation, our LMS-ARPES system is not only more economical and convenient but also with higher photon flux (> 5E13 photons/s), thus enabling the high-resolution and high-statistics measurements. Moreover, the system is equipped with a two-dimensional spin detector based on exchange scattering at a surface-passivated iron film grown on a W(100) substrate. We investigate the spin structure of the prototype topological insulator Bi2Se3 and reveal a high spin-polarization rate, confirming its spin-momentum locking property. This lab-based LMS-ARPES will be a powerful research tool for studying the local fine electronic structures of different condensed matter systems, including topological quantum materials, mesoscopic materials and structures, and phase-separated materials.

cond-mat.mtrl-sci↗

arXiv2022

Crossed Luttinger Liquid Hidden in a Quasi-two-dimensional Material η-Mo4O11

Although the concept of Luttinger liquid (LL) that describes a one-dimensional (1D) interacting fermion system collapses in higher dimensions, it has been proposed to be closely related to many mysteries including the normal state of cuprate superconductor, unconventional metal, and quantum criticality. Therefore, the generalization of LL model to higher dimensions has attracted substantial research attention. Here we systematically investigate the electronic structure of a quasi-2D compound η-Mo4O11 using high-resolution angle-resolved photoemission spectroscopy and ab-initio calculation. Remarkably, we reveal a prototypical LL behavior originating from the crossing quasi-1D chain arrays hidden in the quasi-2D crystal structure. Our results suggest that η-Mo4O11 materializes the long sought-after crossed LL phase, where the orthogonal orbital components significantly reduce the coupling between intersecting quasi-1D chains and therefore maintain the essential properties of LL. Our finding not only presents a realization of 2D LL, but also provides a new angle to understand non-Fermi liquid behaviors in other 2D and 3D quantum materials.

cond-mat.str-el↗

arXiv2022

Direct observation of quantum anomalous vortex in Fe(Se,Te)

Vortices are topological defects of type-II superconductors in an external magnetic field. In a similar fashion to a quantum anomalous Hall insulator, quantum anomalous vortex (QAV) spontaneously nucleates due to orbital-and-spin exchange interaction between vortex core states and magnetic impurity moment, breaking time-reversal symmetry (TRS) of the vortex without an external field. Here, we used scanning superconducting quantum interference device microscopy (sSQUID) to search for its signatures in iron-chalcogenide superconductor Fe(Se,Te). Under zero magnetic field, we found a stochastic distribution of isolated anomalous vortices and antivortices with flux quanta $Φ_0$. By applying a small local magnetic field under the coil of the nano-SQUID device, we observed hysteretic flipping of the vortices reminiscent of the switching of ferromagnetic domains, suggesting locally broken-TRS. We further showed vectorial rotation of a flux line linking a paired vortex-antivortex with the local field. These unique properties of the anomalous vortices satisfied the defining criteria of QAV. Our observation suggests a quantum vortex phase with spontaneous broken-TRS in a high-temperature superconductor.

cond-mat.supr-con↗

arXiv2022

Hybridization and Correlation between f- and d-orbital electrons in a valence fluctuating compound EuNi2P2

The interaction between localized f and itinerant conduction electrons is crucial in the electronic properties of heavy fermion and valence fluctuating compounds. Using high-resolution angle-resolved photoemission spectroscopy, we systematically investigate the electronic structure of the archetypical valence fluctuating compound EuNi2P2 that hosts multiple f electrons. At low temperatures, we reveal the hybridization between Eu 4f and Ni 3d states, which contributes to the electron mass enhancement, consistent with the periodic Anderson model. With increasing temperature, interestingly, we observe opposite temperature evolution of electron spectral function above and below the Kondo coherence temperature near 110 K, which is in contrast to the monotonic valence change and beyond the expectation of the periodic Anderson model. We argue that both f-d hybridization and correlation are imperative in the electronic properties of EuNi2P2. Our results shed light on the understanding of novel properties, such as heavy fermion behaviors and valence fluctuation, of rare-earth transition-metal intermetallic compounds with multiple f electrons.

cond-mat.str-el↗

arXiv2022

Visualization of Chiral Electronic Structure and Anomalous Optical Response in a Material with Chiral Charge Density Waves

Chiral materials have attracted significant research interests as they exhibit intriguing physical properties, such as chiral optical response, spin-momentum locking and chiral induced spin selectivity. Recently, layered transition metal dichalcogenide 1T-TaS2 has been found to host a chiral charge density wave (CDW) order. Nevertheless, the physical consequences of the chiral order, for example, in electronic structures and the optical properties, are yet to be explored. Here, we report the spectroscopic visualization of an emergent chiral electronic band structure in the CDW phase, characterized by windmill-shape Fermi surfaces. We uncover a remarkable chirality-dependent circularly polarized Raman response due to the salient chiral symmetry of CDW, although the ordinary circular dichroism vanishes. Chiral Fermi surfaces and anomalous Raman responses coincide with the CDW transition, proving their lattice origin. Our work paves a path to manipulate the chiral electronic and optical properties in two-dimensional materials and explore applications in polarization optics and spintronics.

cond-mat.mtrl-sci↗

arXiv2022

Observation of non-trivial topological electronic structure of orthorhombic SnSe

Topological electronic structures are key to the topological classification of quantum materials and play an important role in their physical properties and applications. Recently, SnSe has attracted great research interests due to its superior thermoelectric performance. However, it's topological nature has long been ignored. In this work, by combining synchrotron-based angle-resolved photoemission spectroscopy and ab-initio calculations, we systematically investigated the topological electronic structure of orthorhombic SnSe. By identifying the continuous gap in the valence bands due to the band inversion and the topological surface states on its (001) surface, we establish SnSe as a strong topological insulator. Furthermore, we studied the evolution of the topological electronic structure and propose the topological phase diagram in SnSe1-xTex. Our work reveals the topological non-trivial nature of SnSe and provides new understandings of its intriguing transport properties.

cond-mat.mtrl-sci↗