arXiv subjects

Tao Dong

Publications and source records attributed to Tao Dong.

At least 19 recordsLinked to original sources

arXiv2026

Temperature-driven sodium-ion dynamical-to-static crossover in the zig-zag ordered phase of Na$_{0.5}$CoO$_2$

We employ polarization-resolved Raman spectroscopy combined with first-principles calculations to study the sodium-ion lattice dynamics in a sodium zig-zag ordered cobaltate compound Na$_{0.5}$CoO$_2$. We detect two sodium phonon modes for the first time, and their mode frequencies are consistent with first-principles phonon calculations based on an orthorhombic unit cell. We find that they appear below around $T^*\sim300\pm50$K with large linewidth broadening, much lower than the sodium zig-zag ordering temperature $T_\text{S}\sim460$K, and then narrow at lower temperatures. We interpret the sodium-phonon anomalies occurring at $T^*$ as a dynamical-to-static crossover involving mainly the motion of sodium ions. Our results suggest that the gradual freezing of the sodium ions and the well-defined static sodium-zigzag order below $T^*$ set the stage for the emergent electronic and magnetic orders in the CoO$_2$ layer of Na$_{0.5}$CoO$_2$.

cond-mat.mtrl-sci↗

arXiv2026

Coherent seeding and control of dynamical ferroelectricity by phonon anharmonicity

Optical control of quantum materials has progressed along two separate directions: creating non-equilibrium states inaccessible at equilibrium, and coherently controlling ultrafast dynamics with multi-pulse protocols. Ferroelectricity is especially attractive in this context because its order parameter, macroscopic polarization, directly links inversion-symmetry breaking to functional response. Yet light-induced ferroelectricity has so far been confined to quantum paraelectrics near the ferroelectric instability, where critical fluctuations obscure the formation of a homogeneous ferroelectric state and complicate its deterministic coherent control. Unifying these capabilities -- preparing a symmetry-broken state and then coherently steering its functionality -- remains a central challenge. Here we show that intense terahertz excitation of a soft phonon mode induces a ferroelectric state in centrosymmetric PbTe, a thermoelectric material with strong lattice anharmonicity but no ferroelectric transition at finite temperature. The light-induced symmetry-broken state can be realized up to about 100 K, without relying on local dipolar fluctuations. Experiment and theory together reveal that terahertz-driven anharmonic coupling between degenerate transverse optical phonons underlies this ferroelectric induction. Furthermore, we demonstrate coherent amplification and suppression of the induced polarization via a double-pulse-excitation protocol. These results establish terahertz-driven anharmonic mode coupling as a general strategy for controlling mode-mediated functionalities in quantum materials, opening a route to ultrafast information processing.

cond-mat.mtrl-sci↗

arXiv2026

Terahertz frequency upconversion by coherently driving charge dynamics in the InSb/CdTe heterostructure

We investigate terahertz (THz) harmonic generation in the InSb/CdTe heterostructure, demonstrating, for the first time, efficient in-plane magnetic field-induced second-harmonic generation (SHG). We also achieve significant third-harmonic generation (THG), rivalling Dirac materials such as graphene and Cd3As2. Our theoretical analysis identifies the primary SHG mechanism as the orbital-Zeeman correction to Drude conductivity, while the dominant THG contribution also shows Drude-like behavior. The results provide a general route to efficient THz harmonic generation in high mobility materials.

cond-mat.mtrl-sci↗

arXiv2026

CaliPPer: quantifying, predicting and improving AI model performance for binding prediction

Binding prediction models accelerate therapeutic antibody and TCR discovery, but their performance on new datasets is unpredictable, often leading to low discovery rates. Density-ratio methods (PAPE, M-CBPE) provide label-free performance estimation for binary classification, but their assumptions and aggregate-only outputs limit binding prediction on neoepitopes, antigen variants and chemical scaffolds. Here we present CaliPPer (Calibration and Prediction of Performance), a post-hoc framework pairing a multi-chain Sample-to-Domain Distance (S2DD) with distance-aware Bayesian recalibration, operating at three resolutions: generalisability score, aggregate performance prediction, and per-sample confidence. Across ten models, eight architectures and two immune-receptor domains, CaliPPer attains distance--performance correlations $|r|=0.80\text{--}0.92$, predicts AUROC/AP/F1 with mean absolute errors $0.008\text{--}0.070$, and improves AUROC by up to $+0.20$ on unseen epitopes/variants. Applied retrospectively to five published TCR, BCR, MHC--peptide and small-molecule studies, CaliPPer raises true discovery rates in all five (e.g.\ $0/5 \to 3/5$ confirmed neoantigens), providing a triage layer between computational prediction and experimental validation.

cs.CE↗

arXiv2026

Ultrafast Terahertz and Optical Spectroscopy under Synergetic Extreme Conditions

Elucidating and manipulating emergent phases in complex materials requires direct access to their low-energy collective modes. Terahertz (THz) time-domain and ultrafast optical spectroscopies have emerged as indispensable experimental tools, enabling the probing of intrinsic electrodynamics and the coherent control of non-equilibrium states. At the Synergetic Extreme Condition User Facility (SECUF), we have developed a suite of intense ultrashort light sources covering the near-infrared, mid-infrared, and THz spectral ranges. By integrating these strong-field pulses with extreme sample environments, such as low temperatures, strong magnetic fields, and high pressures, we have established several state-of-the-art spectroscopy platforms. In this article, we outline the technical specifications of each setup and highlight representative user experiments. The presented results underscore the exceptional capability of the THz experimental unit (A4-2) to explore ultrafast dynamics across a multi-parameter thermodynamic phase space.

physics.optics↗

arXiv2026

How Coding Agents Fail Their Users: A Large-Scale Analysis of Developer-Agent Misalignment in 20,574 Real-World Sessions

AI coding agents increasingly act directly within software environments, yet existing analyses of their failures rely on benchmark trajectories that miss how developers actually experience misalignment. We present an observational study of 20,574 coding-agent sessions from 1,639 repositories across IDE and CLI workflows. We operationalize misalignment as a breakdown made visible through developer pushback, and annotate each episode along four axes: form, cause, cost, and resolution. We identify seven recurring forms, spanning how agents read projects, interpret developer intent, follow rules, bound their actions, implement and execute code, and report progress. 90.50% of episodes impose effort and trust costs rather than irreversible system damage, yet 91.49% of visible resolutions still require explicit user correction. Misalignment patterns also differ across IDE and CLI settings, persist across adjacent sessions, and shift over time: while overall rates decline, constraint violations and inaccurate self-reporting grow in share. Our findings inform the design of training, evaluation, and interfaces for keeping coding agents aligned with real developer workflows.

cs.SE↗

arXiv2026

Multimodal Terahertz Spectroscopy of the Pairing Symmetry and Normal-State Pseudogap in (La,Pr)$_3$Ni$_2$O$_7$ Films

The discovery of ambient-pressure superconductivity in compressively strained (La,Pr)$_3$Ni$_2$O$_7$ thin films has intensified efforts to identify the pairing mechanism. However, the symmetry of the superconducting order parameter and the character of the normal state remain unsettled. Here we combine bulk-sensitive terahertz (THz) time-domain spectroscopy with THz third-harmonic generation to present spectroscopic insights into these issues. Linear THz spectroscopy reveals a bulk superconducting response in the (La,Pr)$_3$Ni$_2$O$_7$ films, evidenced by the suppression of low-frequency spectral weight below the onset critical temperature, $T_\mathrm{c}^{\mathrm{onset}}$. A weak coherence peak near $T_\mathrm{c}^{\mathrm{onset}}$, together with substantial residual low-frequency conductivity as $T\to 0$, is consistent with disordered $s_{\pm}$-wave pairing. In the nonlinear regime, the third-harmonic signal rises sharply on cooling through $T_\mathrm{c}^{\mathrm{onset}}$, providing an independent signature of the transition. Strikingly, the nonlinear response persists above $T_\mathrm{c}^{\mathrm{onset}}$, pointing to either disorder-enhanced nonlinearity or a distinct correlated normal state. Motivated by angle-resolved photoemission spectroscopy on similarly grown films that identifies a comparable temperature scale, we associate the anomalous normal-state terahertz nonlinearity with a pseudogap. These results establish (La,Pr)$_3$Ni$_2$O$_7$ as a bulk superconductor with $s_{\pm}$-like pairing that coexists with, and may compete with, a distinct ordered state, providing a platform for exploring unconventional superconductivity beyond cuprates and pnictides.

cond-mat.supr-con↗

arXiv2025

From Correctness to Collaboration: Toward a Human-Centered Framework for Evaluating AI Agent Behavior in Software Engineering

As Large Language Models (LLMs) evolve from code generators into collaborative partners for software engineers, our methods for evaluation are lagging. Current benchmarks, focused on code correctness, fail to capture the nuanced, interactive behaviors essential for successful human-AI partnership. To bridge this evaluation gap, this paper makes two core contributions. First, we present a foundational taxonomy of desirable agent behaviors for enterprise software engineering, derived from an analysis of 91 sets of user-defined agent rules. This taxonomy defines four key expectations of agent behavior: Adhere to Standards and Processes, Ensure Code Quality and Reliability, Solving Problems Effectively, and Collaborating with the User. Second, recognizing that these expectations are not static, we introduce the Context-Adaptive Behavior (CAB) Framework. This emerging framework reveals how behavioral expectations shift along two empirically-derived axes: the Time Horizon (from immediate needs to future ideals), established through interviews with 15 expert engineers, and the Type of Work (from enterprise production to rapid prototyping, for example), identified through a prompt analysis of a prototyping agent. Together, these contributions offer a human-centered foundation for designing and evaluating the next generation of AI agents, moving the field's focus from the correctness of generated code toward the dynamics of true collaborative intelligence.

cs.SE↗

arXiv2025

Anomalous terahertz nonlinearity in disordered s-wave superconductor close to the superconductor-insulator transition

Detection of the Higgs mode in superconductors using nonlinear terahertz spectroscopy is a key area of interest in condensed matter physics. We investigate the influence of disorder on the nonlinear terahertz response and the Higgs mode in NbN thin films with varying Ioffe-Regel parameters ($k_Fl$). In strongly disordered films near the superconductor-insulator transition (SIT), we observe an anomalous third-harmonic generation (THG) signal above $T_c$, which is absent in both cleaner superconducting and non-superconducting counterparts. The persistence of this normal-state THG signal in a high magnetic field excludes superconducting fluctuations as its origin. Below $T_c$, the THG intensity increases sharply, indicating a dominant contribution from the driven Higgs mode. The THG spectrum of the strongly disordered sample exhibits a broadened, multi-peak structure, which we attribute to quantum path interference between distinct channels involving unpaired electrons and Cooper pairs within emergent superconducting islands. Our findings not only demonstrate how disorder tunes the nonlinear terahertz response but also uncover a strong coupling between electrons responsible for normal-state THG and the superconducting Higgs mode below $T_c$ in strongly disordered samples.

cond-mat.supr-con↗

arXiv2025

Ultrafast giant enhancement of second harmonic generation in a strongly correlated cobaltite

In quantum materials, nonlinear optical responses are highly sensitive to electronic structure and many-body interactions. Probing and manipulating such nonlinear processes is a complex and subtle endeavor, yet it offers deep insights into emerging physics and functionalities. Here, we report an anomalous ultrafast enhancement of second harmonic generation (SHG) in a strongly correlated cobaltite YbBaCo$_4$O$_7$. Above-bandgap femtosecond pumping increases SHG intensity by up to 60 % within 200 fs, with the enhancement persisting for tens of picoseconds. The enhancement is strongly anisotropic, with substantial amplification of in-plane susceptibility tensors, whereas the out-of-plane counterpart shows negligible change. We attribute these anomalies to ultrafast photodoping-induced modulation of the on-site Coulomb repulsion, which dynamically renormalizes the band structure and selectively amplifies specific $\chi^{(2)}$ components. These nonlinear dynamics encode rich information about the orbital symmetries and energies of the states involved, opening new avenues for all-optical probing of electronic structure in strongly correlated materials.

cond-mat.str-el↗

arXiv2025

Collapse of density wave and emergence of superconductivity in pressurized-La$_4$Ni$_3$O$_{10}$ evidenced by ultrafast spectroscopy

Recent discoveries of superconductivity in Ruddlesden-Popper nickelates realize a rare category of superconductors. However, the use of high-pressure diamond anvil cells limits spectroscopic characterization of the density waves and superconducting gaps. Here, we systematically studied the pressure evolution of La$_{4}$Ni$_{3}$O$_{10}$ using ultrafast optical pump-probe spectroscopy. We found that the transition temperature and energy gap of density waves are suppressed with increasing pressure and disappear suddenly near 17 GPa where structural transition appears. In addition, the observation of a single density wave gap indicates that the spin density wave and charge density wave remain coupled as pressure increases, rather than decoupling. After the density wave collapse, a distinct low-temperature regime emerges, characterized by a small gap consistent with potential superconducting pairing. The separated phase region of superconductivity and density waves suggests that superconductivity in pressurized-La$_4$Ni$_3$O$_{10}$ competes strongly with density waves, offering new insights into the interplay between these two phenomena.

cond-mat.supr-con↗

arXiv2025

Field-induced spin continuum in twin-free Na$_3$Co$_2$SbO$_6$ revealed by magneto-THz spectroscopy

The honeycomb magnet Na$_3$Co$_2$SbO$_6$ recently emerged as a promising candidate for realizing Kitaev quantum spin liquid with relatively low levels of structural disorder. While the precise spin Hamiltonian remains controversial, the potential existence of a quantum spin liquid or other novel quantum magnetic phases continues to stimulate investigation. Here, we study the temperature and magnetic field-dependent spin excitations of Na$_3$Co$_2$SbO$_6$ on a twin-free single crystal using magneto-terahertz (THz) spectroscopy, focusing on magnetic anisotropy and field-induced unusual phases. We observe a low-energy continuum excitation above $T_N$ and a 0.5 THz (2 meV) spin wave excitation in magnetic order under zero field. Upon applying an in-plane magnetic field, the spin waves transform to a magnetic continuum over an intermediate field range, above which the system enters a spin-polarized state. Crucially, the spin excitation spectra reveal striking anisotropy between the $\textbf{a}$ and $\textbf{b}$ crystallographic axes, demanding description by a strongly anisotropic spin model. These findings establish Na$_3$Co$_2$SbO$_6$ as a model system for investigating field-tunable quantum magnetism and potential spin liquid behavior in highly anisotropic systems.

cond-mat.str-el↗

arXiv2025

Ultrafast Orbital-Selective Photodoping Melts Charge Order in Overdoped Bi-based Cuprates

High-temperature superconductivity in cuprates remains one of the enduring puzzles of condensed matter physics, with charge order (CO) playing a central yet elusive role, particularly in the overdoped regime. Here, we employ time-resolved X-ray absorption spectroscopy and resonant X-ray scattering at a free-electron laser to probe the transient electronic density of states and ultrafast CO dynamics in overdoped (Bi,Pb)$_{2.12}$Sr$_{1.88}$CuO$_{6+δ}$. We reveal a striking pump laser wavelength dependence - the 800 nm light fails to suppress CO, whereas the 400 nm light effectively melts it. This behavior originates from the fact that 400 nm photons can promote electrons from the Zhang-Rice singlet band to the upper Hubbard band or apical oxygen states, while 800 nm photons lack the energy to excite electrons across the charge-transfer gap. The CO recovery time ($\sim$3 ps) matches that of the underdoped cuprates, indicating universal electronic instability in the phase diagram. Additionally, melting overdoped CO requires an order-of-magnitude higher fluence highlighting the role of lattice interactions. Our findings demonstrate orbital-selective photodoping and provide a route to ultrafast control of emergent quantum phases in correlated materials.

cond-mat.supr-con↗

arXiv2025

Origin of the density wave instability in trilayer nickelate La$_{4}$Ni$_{3}$O$_{10}$ revealed by optical and ultrafast spectroscopy

In the intricate phase diagram of unconventional superconductors characterized by intertwined electronic orders and superconductivity, a key step in understanding the superconducting mechanism is to investigate the parent compounds from which superconductivity emerges through doping or pressure. In this study, we employed optical spectroscopy and ultrafast reflectivity measurements to examine the density wave instability in the trilayer nickelate La$_{4}$Ni$_{3}$O$_{10}$, which displays pressure-induced superconductivity up to 30 K. Our optical spectroscopy measurements reveal that La$_{4}$Ni$_{3}$O$_{10}$ behaves as a metal with a high plasma frequency. Upon cooling, we observed a distinct formation of a density wave energy gap in both optical conductivity and pump-probe measurements. The gap feature is more pronounced compared to the bilayer nickelate La$_{3}$Ni$_{2}$O$_{7}$. Through a comparison of the experimentally determined plasma frequency with first-principles calculations, we classify La$_{4}$Ni$_{3}$O$_{10}$ as a moderately electron-correlated material, resembling the parent compound of iron-based superconductors but exhibiting weaker correlation than the bilayer nickelate La$_{3}$Ni$_{2}$O$_{7}$. The enhanced gap feature and weaker electronic correlation in La$_{4}$Ni$_{3}$O$_{10}$ may explain its lower superconductivity transition temperature under high pressure. These findings significantly advance our comprehension of the density wave and superconductivity mechanisms in the trilayer nickelate La$_{4}$Ni$_{3}$O$_{10}$.

cond-mat.str-el↗

arXiv2025

Photo-induced Dynamics and Momentum Distribution of Chiral Charge Density Waves in 1T-TiSe$_{2}$

Exploring the photoinduced dynamics of chiral states offers promising avenues for advanced control of condensed matter systems. Photoinduced or photoenhanced chirality in 1T-TiSe$_{2}$ has been suggested as a fascinating platform for optical manipulation of chiral states. However, the mechanisms underlying chirality training and its interplay with the charge density wave (CDW) phase remain elusive. Here, we use time-resolved X-ray diffraction (tr-XRD) with circularly polarized pump lasers to probe the photoinduced dynamics of chirality in 1T-TiSe$_{2}$. We observe a notable ($\sim$20%) difference in CDW intensity suppression between left- and right-circularly polarized pumps. Additionally, we reveal momentum-resolved circular dichroism arising from domains of different chirality, providing a direct link between CDW and chirality. An immediate increase in CDW correlation length upon laser pumping is detected, suggesting the photoinduced expansion of chiral domains. These results both advance the potential of light-driven chirality by elucidating the mechanism driving chirality manipulation in TiSe$_2$, and they demonstrate that tr-XRD with circularly polarized pumps is an effective tool for chirality detection in condensed matter systems.

cond-mat.str-el↗

arXiv2024

Transient and Periodic Steady-State Characteristics of the Local Heat Transfer Measurement by Thermal Perturbation with Gaussian Power Density Distribution & A Supplementary Perspective with Comments

The local heat transfer coefficient measurement with temperature oscillation induced by periodic thermal perturbation - usually via a Gaussian laser beam, was investigated for the impact of the spikiness (i.e., the standard deviation) elaborated in comparison with the analytical model for dimensional analysis. The statistically more robust technique that relies on the linearity of the spatial phase distribution of the test point array was favored when the target Biot number approaches unity in terms of its order of magnitude. The preferred upper limit for thermographic scanning was discussed as the simplification of later data processing is concerned. Nonetheless, the time elapsed for an acceptable periodic steady state, which in principle leans to the higher end of the target Biot number spectrum in a log scale, indicates the benefit from the time series of pointwise temperature measurement - as in the conventional single-blow testing, where the effect of spikiness, as well as that of the location of individual test point, holds. Note that the vicinity as the target Biot number approaches unity was again observed with higher preference. A supplementary perspective was provided to the concerns, including noise tolerance, sampling rate, test duration, the spikiness of the imposed heat flux, and the accuracy-related parameters, in the measurement of local Biot number with thermal perturbation. The optimization was implemented with a Gaussian process surrogate model for data processing, within the specified parametric range of interest. The two commonly employed temporal modes of the imposed heat flux were compared with counterintuitive features discussed.

physics.data-an↗

arXiv2024

Selective excitation of collective modes in multiband superconductor MgB2

Recent developments in nonequilibrium and nonlinear terahertz (THz) spectroscopies have significantly advanced our understanding of collective excitations in superconductors. However, there is still debate surrounding the identification of Higgs or Leggett modes, as well as BCS charge fluctuations, in the well-known two-band superconductor MgB$_2$. Here, we utilized both multi-cycle and single-cycle THz pump-broadband THz probe techniques to investigate the THz nonlinear response of MgB$_2$. Through multicycle THz pump-THz probe experiments on MgB$_2$, we observed distinct nonlinear signals at both the fundamental frequency ($ω$) and the second harmonic frequency (2$ω$) of the pump pulses, which exhibited resonant enhancement at temperatures where their frequencies respectively match 2$Δ_π(T)$. They are mainly attributed to the $π$-band Higgs mode. By adjusting the THz pump pulse to a single-cycle waveform that satisfies non-adiabatic excitation criteria, we observed an over-damped oscillation corresponding to the Leggett mode. Our findings contribute to solving the ongoing debates and demonstrate the selective excitation of collective modes in multiband superconductors, offering new insights into the interaction between Higgs and Leggett modes.

cond-mat.supr-con↗

arXiv2024

Room-temperature non-volatile optical manipulation of polar order in a charge density wave

Utilizing ultrafast light-matter interaction to manipulate electronic states of quantum materials is an emerging area of research in condensed matter physics. It has significant implications for the development of future ultrafast electronic devices. However, the ability to induce long-lasting metastable electronic states in a fully reversible manner is a long-standing challenge.Here, by using ultrafast laser excitations, we demonstrate the capability to manipulate the electronic polar states in the charge-density-wavematerial EuTe4 in a non-volatile manner. The process is completely reversible and is achieved at room temperature with an all-optical approach. Each induced non-volatile state brings about modifications to the electrical resistance and second harmonic generation intensity. The results point to layer-specific phase inversion dynamics by which photoexcitation mediates the stacking polar order of the system. Our findings extend the scope of non-volatile all-optical control of electronic states to ambient conditions, and highlight a distinct role of layerdependent phase manipulation in quasi-two-dimensional systems with inherent sublayer stacking orders.

cond-mat.str-el↗