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Ge He

Publications and source records attributed to Ge He.

At least 19 recordsLinked to original sources

Emergent Vibronic Spectral Hierarchy in a Kagome Flat-Band Insulator

Electron-phonon coupling is usually understood in terms of electronic quasiparticles interacting with dispersive lattice vibrations. Much less is known about the complementary limit in which the relevant phonon mode is itself localized or weakly dispersive. Here we investigate this regime in the kagome compound Rb$_{2}$Ni$_{3}$S$_{4}$, which undergoes an unconventional insulating transition near $T^{*} \approx$ 260-280~K. Combining polarization-resolved Raman spectroscopy with temperature-dependent x-ray diffraction, scanning tunneling microscopy, and electrical, thermal, and magnetic measurements, we show that the transition involves electronic localization without a conventional structural or magnetic order parameter. Raman spectra reveal a giant Franck-Condon progression associated with a nearly dispersionless 333.7~cm$^{-1}$ phonon, decorated by an equally spaced comb-like fine structure with a characteristic spacing of 40.6~cm$^{-1}$. The comb spacing is insensitive to magnetic field, whereas its spectral weight is strongly field tunable. Rather than treating either hierarchy alone as pure phonon effect, we interpret their nested coexistence as evidence for a strongly coupled electron-vibrational manifold involving a localized lattice coordinate. These results identify dispersionless phonons as an active route to vibronic correlations in solids and suggest that such electron-vibrational self-trapping is closely associated with the insulating phase of Rb$_{2}$Ni$_{3}$S$_{4}$.

cond-mat.str-el

Unconventional Pressure Evolution of Spin-Density-Wave State in La$_{3}$Ni$_{2}$O$_{7}$

The discovery of pressure-induced high temperature superconductivity in the bilayer nickelate La$_{3}$Ni$_{2}$O$_{7}$ has raised the question of how its spin-density-wave (SDW) state evolves toward the superconducting regime. Here, we report a systematic electronic Raman study of La$_{3}$Ni$_{2}$O$_{7}$ single crystals under hydrostatic pressures up to 16.51 GPa. Both the SDW gap energy and the transition temperature $T_{\mathrm{SDW}}$ show an overall increase with pressure, while the dimensionless coupling ratio 2$\Delta_{\text{SDW}}/(k_{\text{B}}T_{\text{SDW}})$ remains constant around $\sim7.5$, indicating a robust strong-coupling character of SDW state. At the same time, the Raman SDW peak broadens as pressure is applied, indicating a gradual weakening of long-range SDW order. These results reveal an unusual pressure evolution in which the SDW energy scale is enhanced while the SDW state becomes progressively less coherent, providing spectroscopic constraints on the magnetic correlations relevant to superconductivity in bilayer nickelates.

cond-mat.supr-con

Fractional phase slips across the charge-density-wave domain walls in 1-T TiSe2

The microscopic origin of the charge density wave (CDW) in 1\textit{T}-TiSe$_2$ remains controversial, with competing scenarios based on phonon-driven lattice instability and electronically driven excitonic correlations. Here, we combine low-temperature scanning tunneling microscopy with two-dimensional lock-in phase analysis to directly resolve the local CDW phase in real space and track its evolution across individual domain walls. In homogeneous regions, the CDW phase remains uniform; by contrast, across domain walls we uncover a robust and reproducible $2\pi/3$ phase shift that occurs collectively in all three symmetry-related CDW components. This nontrivial and correlated phase-slip configuration places stringent constraints on the order-parameter manifold and challenges the simplest purely phonon-driven commensurate lock-in picture, which would instead predict a $\pi$ phase shift. A minimal free-energy model incorporating both electron-phonon and electron-hole interactions reproduces the observed phase behavior and indicates that electronic interactions play an important role in shaping the local phase structure of the CDW order. These results establish domain walls as direct real-space probes of the microscopic interactions underlying multicomponent order and provide a general phase-resolved framework for constraining competing ordering mechanisms in correlated materials.

cond-mat.str-el

Reconfiguring flexibility in renewable power-to-ammonia systems using molten-salt thermal energy storage in the ammonia synthesis loop: A coordinated electro-hydrogen-thermal scheduling approach

In renewable power-to-ammonia (ReP2A) systems, the intermittency of wind and solar generation propagates through electrolytic hydrogen production and induces thermal instability in the ammonia synthesis reactor (ASR). The resulting temperature cycling accelerates fatigue and shortens service life, while reactor thermal inertia limits flexible start-up, shutdown, and load adjustment. To address this issue, this study integrates molten-salt thermal energy storage (MS-TES) into the Haber-Bosch synthesis loop and develops a coordinated electro-hydrogen-thermal scheduling framework. MS-TES decouples hydrogen supply fluctuations from reactor thermal dynamics by enabling hot standby operation and sustained thermal support during start-up and low-load conditions. A state-space model is established to capture the thermal dynamics of the ASR and MS-TES. Based on this model, an optimal scheduling program coordinates ammonia synthesis operation with hydrogen production, battery energy storage (BES), and hydrogen storage (HS). The problem is formulated as a mixed-integer linear program (MILP) and extended with information gap decision theory (IGDT) to address renewable uncertainty. Case studies based on an industrial-scale project in northern China show that MS-TES enhances reactor thermal stability and system-level flexibility, while diminishing the marginal benefit of large BES capacity. As a result, a configuration combining small BES, HS, and MS-TES achieves near-equivalent performance to large-BES systems, with lower investment and improved economic returns. Year-round simulations further show that MS-TES avoids ASR start-up and shutdown and delivers consistently higher net revenue under variable renewable conditions.

math.OC

Anisotropic Electronic Correlations in the Spin Density Wave State of La$_3$Ni$_2$O$_7$

The bilayer nickelate superconductor La$_3$Ni$_2$O$_7$ undergoes a density wave transition near 150 K that has attracted intensive scrutiny, yet its microscopic origin remains elusive. Here we report polarization-resolved electronic Raman scattering measurements on high-quality single crystals of La$_3$Ni$_2$O$_7$. Below 150\,K, we observe a pronounced, symmetry-dependent redistribution of spectral weight in B$_{1g}$ and B$_{2g}$ channels, consistent with the formation of spin-density-wave (SDW) gaps. Quantitative analysis reveals momentum-selective SDW gap amplitudes, with intermediate-to-strong coupling near X/Y points of the Brillouin zone and weaker coupling along the diagonal direction, indicating an unconventional SDW driven by anisotropic electronic correlations. Our results establish the electronic character of the SDW in La$_3$Ni$_2$O$_7$, and provide a microscopic foundation for understanding the emergence of high-temperature superconductivity under pressure in nickelates.

cond-mat.supr-con

Contrasting Momentum-Selective Spin-Density-Wave Gaps in Bilayer and Trilayer Nickelates

Resolving where the density-wave gap opens in momentum space is essential for identifying the microscopic origin of the instability in layered nickelates. Using polarization-resolved electronic Raman scattering, we map the momentum selectivity of the spin-density-wave (SDW) gap in trilayer La4Ni3O10. We observe a SDW-induced redistribution of spectral weight on both the $\alpha$ pocket at the Brillouin-zone centre and a portion of the $\beta$ pocket near the zone boundary, characterized by gap energies of approximately 55~meV. In contrast, no comparable spectral weight suppression is observed along the diagonal region of $\beta$ pockets, implying little or no gap opening. This gap topology contrasts sharply with that in La3Ni2O7, where anisotropic SDW gaps open solely on the $\beta$ pocket. Our results establish a distinct momentum-space gap topology between bilayer and trilayer nickelates, placing new constraints on the ordering wave vector and the mechanism of the density-wave instability relevant to superconductivity.

cond-mat.supr-con

Dynamic Modeling and Control of Multi-Stack Alkaline Water Electrolysis Systems with Shared Gas Separators and Lye Circulation:Industrial Data-Based Validation and Simulation

An emerging approach for large-scale renewable hydrogen production is integrating multiple alkaline water electrolysis (AWE) stacks into one balance-of-plant (BoP) system, sharing gas-lye separation and lye circulation components. While this configuration, termed $N$-in-1, reduces cost and complexity, its dynamic performance under fluctuating power remains unclear compared with conventional 1-in-1 systems. This paper develops a state-space model of the multi-stack AWE system, capturing lye circulation, temperature, and hydrogen-to-oxygen (HTO) dynamics, calibrated via experiments on a 4,000 Nm$^3$/h-rated 4-in-1 system. A mixed-integer quadratic programming (MIQP)-based predictive controller is then designed to coordinate inter-stack current distribution, lye flow, and cooling for load tracking and operational stability. Simulations on the experimentally validated model show that a $4$-in-1 system achieves similar performance compared to four parallel 1-in-1 systems under continuous operation. Differences in load-tracking, temperature stabilization errors, and specific energy consumption remain below 0.015 MW, 0.346 K, and 0.001 kWh/Nm$^3$ under wind power supply when all stacks remain online.

math.OC

Planning of Off-Grid Renewable Power to Ammonia Systems with Heterogeneous Flexibility: A Multistakeholder Equilibrium Perspective

Off-grid renewable power to ammonia (ReP2A) systems present a promising pathway toward carbon neutrality in both the energy and chemical industries. However, due to chemical safety requirements, the limited flexibility of ammonia synthesis poses a challenge when attempting to align with the variable hydrogen flow produced from renewable power. This necessitates the optimal sizing of equipment capacity for effective and coordinated production across the system. Additionally, an ReP2A system may involve multiple stakeholders with varying degrees of operational flexibility, complicating the planning problem. This paper first examines the multistakeholder sizing equilibrium (MSSE) of the ReP2A system. First, we propose an MSSE model that accounts for individual planning decisions and the competing economic interests of the stakeholders of power generation, hydrogen production, and ammonia synthesis. We then construct an equivalent optimization problem based on Karush-Kuhn-Tucker (KKT) conditions to determine the equilibrium. Following this, we decompose the problem in the temporal dimension and solve it via multicut generalized Benders decomposition (GBD) to address long-term balancing issues. Case studies based on a realistic project reveal that the equilibrium does not naturally balance the interests of all stakeholders due to their heterogeneous characteristics. Our findings suggest that benefit transfer or re-arrangement ensure mutual benefits and the successful implementation of ReP2A projects.

math.OC

Generating Comprehensive Lithium Battery Charging Data with Generative AI

In optimizing performance and extending the lifespan of lithium batteries, accurate state prediction is pivotal. Traditional regression and classification methods have achieved some success in battery state prediction. However, the efficacy of these data-driven approaches heavily relies on the availability and quality of public datasets. Additionally, generating electrochemical data predominantly through battery experiments is a lengthy and costly process, making it challenging to acquire high-quality electrochemical data. This difficulty, coupled with data incompleteness, significantly impacts prediction accuracy. Addressing these challenges, this study introduces the End of Life (EOL) and Equivalent Cycle Life (ECL) as conditions for generative AI models. By integrating an embedding layer into the CVAE model, we developed the Refined Conditional Variational Autoencoder (RCVAE). Through preprocessing data into a quasi-video format, our study achieves an integrated synthesis of electrochemical data, including voltage, current, temperature, and charging capacity, which is then processed by the RCVAE model. Coupled with customized training and inference algorithms, this model can generate specific electrochemical data for EOL and ECL under supervised conditions. This method provides users with a comprehensive electrochemical dataset, pioneering a new research domain for the artificial synthesis of lithium battery data. Furthermore, based on the detailed synthetic data, various battery state indicators can be calculated, offering new perspectives and possibilities for lithium battery performance prediction.

cs.LG

Flexible Parallel Neural Network Architecture Model for Early Prediction of Lithium Battery Life

The early prediction of battery life (EPBL) is vital for enhancing the efficiency and extending the lifespan of lithium batteries. Traditional models with fixed architectures often encounter underfitting or overfitting issues due to the diverse data distributions in different EPBL tasks. An interpretable deep learning model of flexible parallel neural network (FPNN) is proposed, which includes an InceptionBlock, a 3D convolutional neural network (CNN), a 2D CNN, and a dual-stream network. The proposed model effectively extracts electrochemical features from video-like formatted data using the 3D CNN and achieves advanced multi-scale feature abstraction through the InceptionBlock. The FPNN can adaptively adjust the number of InceptionBlocks to flexibly handle tasks of varying complexity in EPBL. The test on the MIT dataset shows that the FPNN model achieves outstanding predictive accuracy in EPBL tasks, with MAPEs of 2.47%, 1.29%, 1.08%, and 0.88% when the input cyclic data volumes are 10, 20, 30, and 40, respectively. The interpretability of the FPNN is mainly reflected in its flexible unit structure and parameter selection: its diverse branching structure enables the model to capture features at different scales, thus allowing the machine to learn informative features. The approach presented herein provides an accurate, adaptable, and comprehensible solution for early life prediction of lithium batteries, opening new possibilities in the field of battery health monitoring.

cs.LG

Anharmonic Strong-Coupling Effects at the Origin of the Charge Density Wave in CsV$_3$Sb$_5$

The formation of charge density waves (CDW) is a long-standing open problem particularly in dimensions higher than one. Various observations in the vanadium antimonides discovered recently, such as the missing Kohn anomaly in the acoustic phonons or the latent heat at the transition $T_{\rm CDW}$ = 95 K , further underpin this notion. Here, we study the Kagome metal CsV$_3$Sb$_5$ using polarized inelastic light scattering. The electronic energy gap $2\Delta$ as derived from the redistribution of the continuum is much larger than expected from mean-field theory and reaches values above 20 for $2\Delta/k_{\rm B}T_{\rm CDW}$. The A$_{1g}$ phonon has a discontinuity at $T_{\rm CDW}$ and a precursor starting 20 K above $T_{\rm CDW}$. Density functional theory qualitatively reproduces the redistribution of the electronic continuum at the CDW transition and the phonon energies of the pristine and distorted structures. The linewidths of all A$_{1g}$ and E$_{2g}$ phonon lines including those emerging below $T_{\rm CDW}$ were analyzed in terms of anharmonic symmetric decay revealing strong phonon-phonon coupling. In addition, we observe two CDW amplitude modes (AMs): one in A$_{1g}$ symmetry and one in E$_{2g}$ symmetry. The temperature dependence of both modes deviates from the prediction of mean-field theory. The A$_{1g}$ AM displays an asymmetric Fano-type lineshape, suggestive of strong electron-phonon coupling. The asymmetric A$_{1g}$ AM, along with the discontinuity of the A$_{1g}$ phonon, the large phonon-phonon coupling parameters and the large gap ratio, indicate the importance of anharmonic strong phonon-phonon and electron-phonon coupling for the CDW formation in CsV$_3$Sb$_5$.

cond-mat.supr-con

Polarized tip-enhanced Raman spectroscopy at liquid He temperature in ultrahigh vacuum using an off-axis parabolic mirror

Tip-enhanced Raman spectroscopy (TERS) combines inelastic light scattering well below the diffraction limit down to the nanometer range and scanning probe microscopy and, possibly, spectroscopy. In this way, topographic and spectroscopic as well as single- and two-particle information may simultaneously be collected. While single molecules can now be studied successfully, bulk solids are still not meaningfully accessible. It is the purpose of the work presented here to outline approaches toward this objective. We describe a home-built, liquid helium cooled, ultrahigh vacuum tip-enhanced Raman spectroscopy system (LHe-UHV-TERS). The setup is based on a scanning tunneling microscope and, as an innovation, an off-axis parabolic mirror having a high numerical aperture of approximately $0.85$ and a large working distance. The system is equipped with a fast load-lock chamber, a chamber for the \textit{in situ} preparation of tips, substrates, and samples, and a TERS chamber. Base pressure and temperature in the TERS chamber were approximately $3\times 10^{-11}$~mbar and 15~K, respectively. Polarization dependent tip-enhanced Raman spectra of the vibration modes of carbon nanotubes were successfully acquired at cryogenic temperature. Enhancement factors in the range of $10^7$ were observed. The new features described here including very low pressure and temperature and the external access to the light polarizations, thus the selection rules, may pave the way towards the investigation of bulk and surface materials.

cond-mat.supr-con

A disorder-sensitive emergent vortex phase identified in high-Tc superconductor (Li,Fe)OHFeSe

The magneto-transport properties are systematically measured under c-direction fields up to 33 T for a series of single-crystal films of intercalated iron-selenide superconductor (Li,Fe)OHFeSe. The film samples with varying degree of disorder are grown hydrothermally. We observe a magnetic-field-enhanced shoulder-like feature in the mixed state of the high-Tc (Li,Fe)OHFeSe films with weak disorder, while the feature fades away in the films with enhanced disorder. The irreversibility field is significantly suppressed to lower temperatures with the appearance of the shoulder feature. Based on the experiment and model analysis, we establish a new vortex phase diagram for the weakly disordered high-Tc (Li,Fe)OHFeSe, which features an emergent dissipative vortex phase intermediate between the common vortex glass and liquid phases. The reason for the emergence of this intermediate vortex state is further discussed based on related experiments and models.

cond-mat.supr-con

Quantum critical fluctuations in an Fe-based superconductor

Quantum critical fluctuations may prove to play an instrumental role in the formation of unconventional superconductivity. Here, we show that the characteristic scaling of a marginal Fermi liquid is present in inelastic light scattering data of an Fe-based superconductor tuned through a quantum critical point (QCP) by chemical substitution or doping. From the doping dependence of the imaginary time dynamics we are able to distinguish regions dominated by quantum critical behavior from those having classical critical responses. This dichotomy reveals a connection between the marginal Fermi liquid behavior and quantum criticality. In particular, the overlap between regions of high superconducting transition temperatures and quantum critical scaling suggests a contribution from quantum fluctuations to the formation of superconductivity.

cond-mat.supr-con

Phonon anomalies associated with spin reorientation in the Kagome ferromagnet Fe3Sn2

Polarization- and temperature-dependent Raman data along with theoretical simulations are presented for the Kagome ferromagnet Fe_3Sn_2. Eight out of nine expected phonon modes were identified. The experimental energies compare well with those from the simulations. The analysis of the line widths indicates relatively strong phonon-phonon coupling in the range 0.1 to 1. The temperature-dependent frequencies of three A_{1g} modes show weak anomalies at approximately 100 K. In contrast, the linewidths of all phonon modes follow the conventional exponential broadening up to room temperature except for the softest A_{1g} mode, whose width exhibits a kink close to 100 K and becomes nearly constant for T > 100 K. These features are indicative of a spin reorientation taking place in the temperature range above 100 K which might arise from spin-phonon coupling. The low-energy part of the electronic continuum in E_g symmetry depends strongly on temperature. The possible reasons include particle-hole excitation tracking the resistivity, a spin-dependent gap or spin fluctuations.

cond-mat.mtrl-sci

Universal scaling of the critical temperature and the strange-metal scattering rate in unconventional superconductors

Dramatic evolution of properties with minute change in the doping level is a hallmark of the complex chemistry which governs cuprate superconductivity as manifested in the celebrated superconducting domes as well as quantum criticality taking place at precise compositions. The strange metal state, where the resistivity varies linearly with temperature, has emerged as a central feature in the normal state of cuprate superconductors. The ubiquity of this behavior signals an intimate link between the scattering mechanism and superconductivity. However, a clear quantitative picture of the correlation has been lacking. Here, we report observation of quantitative scaling laws between the superconducting transition temperature $T_{\rm c}$ and the scattering rate associated with the strange metal state in electron-doped cuprate $\rm La_{2-x}Ce_xCuO_4$ (LCCO) as a precise function of the doping level. High-resolution characterization of epitaxial composition-spread films, which encompass the entire overdoped range of LCCO has allowed us to systematically map its structural and transport properties with unprecedented accuracy and increment of $\Delta x = 0.0015$. We have uncovered the relations $T_{\rm c}\sim(x_{\rm c}-x)^{0.5}\sim(A_1^\square)^{0.5}$, where $x_c$ is the critical doping where superconductivity disappears on the overdoped side and $A_1^\square$ is the scattering rate of perfect $T$-linear resistivity per CuO$_2$ plane. We argue that the striking similarity of the $T_{\rm c}$ vs $A_1^\square$ relation among cuprates, iron-based and organic superconductors is an indication of a common mechanism of the strange metal behavior and unconventional superconductivity in these systems.

cond-mat.supr-con

Probing charge density wave phases and the Mott transition in $1T$-TaS$_2$ by inelastic light scattering

We present a polarization-resolved, high-resolution Raman scattering study of the three consecutive charge density wave (CDW) regimes in $1T$-TaS$_2$ single crystals, supported by \textit{ab initio} calculations. Our analysis of the spectra within the low-temperature commensurate (C-CDW) regime shows $\mathrm{P3}$ symmetry of the system, thus excluding the previously proposed triclinic stacking of the "star-of-David" structure, and promoting trigonal or hexagonal stacking instead. The spectra of the high-temperature incommensurate (IC-CDW) phase directly project the phonon density of states due to the breaking of the translational invariance, supplemented by sizeable electron-phonon coupling. Between 200 and 352\,K, our Raman spectra show contributions from both the IC-CDW and the C-CDW phase, indicating their coexistence in the so-called nearly-commensurate (NC-CDW) phase. The temperature-dependence of the symmetry-resolved Raman conductivity indicates the stepwise reduction of the density of states in the CDW phases, followed by a Mott transition within the C-CDW phase. We determine the size of the Mott gap to be $\Omega_{\rm gap}\approx 170-190$ meV, and track its temperature dependence.

cond-mat.str-el

Ionic liquid gating induced two superconductor-insulator phase transitions in spinel oxide Li$_{1 \pm x}$Ti$_2$O$_{4-\delta}$

The associations between emergent physical phenomena (e.g., superconductivity) and orbital, charge, and spin degrees of freedom of $3d$ electrons are intriguing in transition metal compounds. Here, we successfully manipulate the superconductivity of spinel oxide Li$_{1\pm x}$Ti$_2$O$_{4-\delta}$ (LTO) by ionic liquid gating. A dome-shaped superconducting phase diagram is established, where two insulating phases are disclosed both in heavily electron-doping and hole-doping regions. The superconductor-insulator transition (SIT) in the hole-doping region can be attributed to the loss of Ti valence electrons. In the electron-doping region, LTO exhibits an unexpected SIT instead of a metallic behavior despite an increase in carrier density. Furthermore, a thermal hysteresis is observed in the normal state resistance curve, suggesting a first-order phase transition. We speculate that the SIT and the thermal hysteresis stem from the enhanced $3d$ electron correlations and the formation of orbital ordering by comparing the transport and structural results of LTO with the other spinel oxide superconductor MgTi$_2$O$_4$, as well as analysing the electronic structure by first-principles calculations. Further comprehension of the detailed interplay between superconductivity and orbital ordering would contribute to the revealing of unconventional superconducting pairing mechanism.

cond-mat.supr-con