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Yu Zhu

Publications and source records attributed to Yu Zhu.

At least 19 recordsLinked to original sources

Josephson energy of superconducting junctions: amorphous versus crystalline tunnel barriers

The Josephson energy $E_J$ is a key parameter governing the properties of transmon superconducting qubits. In Al/AlO$_x$/Al junctions, $E_J$ is set by electron tunneling through an ultrathin oxide barrier and therefore depends exponentially on the atomic structure of the barrier. We compute $E_J$ by first-principles device modeling based on the NEGF-DFT quantum-transport method, comparing a junction with a crystalline Al$_2$O$_3$ barrier against ten junctions with melt--quenched amorphous Al$_2$O$_3$ barriers of the same thickness. From the Fermi-level transmission and the Ambegaokar--Baratoff relation, we obtain a mean $E_J/h$ of $2.78$ GHz for the amorphous ensemble, with a standard deviation of $4.67$ GHz, compared with $0.73$ GHz for the crystalline reference; individual amorphous values span nearly two orders of magnitude. Scattering-state analysis shows that transport is quantum tunneling and that the variability originates from stoichiometric inhomogeneity of the amorphous oxide: Al-rich, low-barrier regions can connect into percolation-like tunneling pathways that strongly enhance the conductance. A realistic $200\times200$ nm$^2$ junction self-averages over more than $2\times10^4$ such microscopic regions. These results establish a quantitative atomistic route from oxide microstructure to the superconducting-circuit energy scale $E_J$.

quant-ph

On Diagonalizable Delay-Doppler Channels and Their Diagonalizing Waveforms

In doubly selective channels, the joint delay and Doppler dispersion generally induces coupling among transmitted symbols, thereby increasing receiver equalization complexity. Nevertheless, by using appropriately designed waveforms, channels with certain delay-Doppler (DD) supports can be diagonalized for one-tap equalization. The whole picture of such DD supports and their corresponding waveforms is still unclear, except for several examples identified in literature. In this paper, under cyclic-prefix (CP)-based block transmission and assuming that the modulation waveforms form an orthonormal basis, we identify all such channel supports by an elementary expression, and derive the corresponding waveforms in closed form.

cs.IT

Ontology-Guided Multi-Agent Extraction of Evaluation Objects from Academic Review Texts: Evidence from Chinese Library and Information Science

Academic reviews, scholarly commentaries, and book reviews serve as sources of evaluative statements about theories, methods, literature, institutions, and policies, providing valuable evidence for scholarly evaluation. Existing scientific entity extraction methods mainly target research articles and are less effective for evaluation objects, which are often abstract, context-dependent, and characterized by ambiguous type boundaries. This study proposes an ontology-guided multi-agent framework for evaluation object extraction. The framework combines candidate discovery, ontology-constrained classification, and domain review. Experimental results show that it achieves a Precision of 90.33%, Recall of 84.55%, Entity-level F1 of 87.34%, Strict Typed F1 of 79.78%, and Type Accuracy of 91.35%, substantially outperforming rule-based and zero-shot baselines. Ablation results indicate that the multi-agent workflow improves recall and stability, while ontology-based boundary constraints enhance fine-grained classification and reduce category confusion. The framework supports the structured utilization of evaluative scholarly texts and provides methodological support for evidence-based research evaluation and STI mining.

cs.CL

Large-Small Model Collaboration for Zero-Shot Surgical Phase Recognition

Task-specific lightweight models for surgical phase recognition excel at capturing temporal dynamics but generalize poorly under domain shift. Conversely, surgical foundation models (FMs) offer superior transferability via large-scale pretraining, yet their lack of explicit temporal modeling often yields temporally inconsistent predictions, leading to degraded performance. To exploit the complementary strengths of both paradigms, we propose \textbf{La}rge-\textbf{S}mall \textbf{T}emporal adaptation (\textbf{LaST}), a novel large-small collaborative framework that enables zero-shot adaptation to unseen clinical domains. In LaST, the FM initiates the pipeline by generating frame-level phase priors that serve as initial weak supervision. To effectively utilize these noisy phase priors, we introduce an iterative temporal refinement scheme that integrates dynamic quality control to filter reliable predictions and dual-model cross-learning to mitigate confirmation bias. Simultaneously, the lightweight model leverages its intrinsic temporal modeling ability to progressively correct inconsistent predictions and enhance overall accuracy across iterations. At the end, a cycle replay strategy is employed to close the loop: the refined, more accurate predictions are utilized as upgraded supervision signals for the subsequent iterations, fostering a self-reinforcing evolution of both label quality and model capability. Extensive experiments demonstrate that LaST achieves robust adaptation to unseen domains for zero-shot surgical phase recognition, outperforming the baseline (PeskaVLP) by 24.85\%-43.17\% in accuracy and even surpassing fully supervised linear probing and several state-of-the-art few-shot approaches. Codes will be released at https://github.com/YIYIZH/LaST.

cs.CV

Extremal cross $t$-intersecting families under $t$-covering number constraints for vector spaces

Let $V$ be an $n$-dimensional vector space over the finite field $\mathbb{F}_q$, and ${V\brack k}$ denote the family of all $k$-dimensional subspaces of $V$. The families $\mathcal{F}\subseteq {V\brack k}$ and $\mathcal{G}\subseteq {V\brack \ell}$ are said to be cross $t$-intersecting if $\dim(F\cap G)\geq t$ for all $F\in\mathcal{F}$ and $G\in \mathcal{G}$. In this paper, we determine the extremal structures when $|\mathcal{F}||\mathcal{G}|$ attains the maximum value under the conditions $\dim\left(\cap_{F\in \mathcal{F}}F\right)<t$ and $\dim\left(\cap_{G\in \mathcal{G}}G\right)<t$.

math.CO

EasyBCI Agent: Towards Universal Neural Data Preprocessing for Brain-Computer Interfaces

Brain-computer interfaces translate neural activity into device commands, yet their performance hinges on preprocessing that remains manual, expert-dependent and poorly reproducible. Large language model agents can automate scientific coding, but existing systems lack the modality coverage, raw-data isolation, experience accumulation and domain oversight that neural preprocessing requires. We introduce EasyBCI, a two-phase LLM agent that plans and executes preprocessing pipelines for six signal types. A Plan Agent profiles each recording into a text-only Data Fingerprint that never exposes raw data to the model and selects a literature-grounded operator sequence. An Execution Agent generates, runs and self-corrects code until quality criteria are met, while a quality-gated experience system retains validated strategies as reusable skills. A domain expert intervenes at two decision gates, retaining human judgement where undetected error can invalidate downstream analyses. Evaluation on EEG with a fixed linear classifier shows that all five EasyBCI backbones preserve more task-relevant separability than the manual pipeline. Under same-backbone comparison, EasyBCI outperforms general-purpose coding agents on both label schemes for four of five configurations. EasyBCI extends to five additional modalities spanning nearly three orders of magnitude in sampling rate, producing complete reproducible pipelines with recorded decision provenance. These results indicate that domain-specific orchestration can bring auditable preprocessing within reach of laboratories lacking dedicated expertise, illustrating design principles applicable to AI agents in other scientific domains.

q-bio.QM

SeekBrain: An Autonomous Multi-Agent System for Accelerating Neuroscience Discovery

Modern neuroscience relies on integrating multi-scale, multimodal datasets to uncover the neural principles underlying intelligence. However, analytical challenges posed by highly heterogeneous data and fragmented workflows increasingly constrain discoveries. Here we introduce SeekBrain, an autonomous multi-agent framework designed to accelerate neuroscience discovery through domain-grounded hierarchical planning and cross-modal data analysis. SeekBrain dynamically constructs a repertoire of analysis recipes extracted from code-paper pairs. By coupling this codified expertise with agentic planning and execution engines, the framework scalably generates hypotheses and analytical pipelines on demand. Systematic evaluation on the expert-annotated BrainArena benchmark demonstrates that SeekBrain substantially outperforms state-of-the-art agent baselines across various analysis tasks. Crucially, when deployed in real-world research, SeekBrain integrated behavioral, neural, and anatomical data to reveal structured, distributed neural representations of larval zebrafish behavior and a shared axis of regional decoding strength across the brain in a mouse decision-making task. These results establish SeekBrain as a scalable and practical tool for accelerating data-driven discoveries in neuroscience.

cs.MA

Application-Driven Architecture Exploration for Cross-Layer Heterogeneous Systems

AI and HPC infrastructure increasingly serves workload portfolios that combine dense tensor computation, sparse kernels, large memory footprints, and communication-intensive collectives. Supporting these portfolios requires coordinated choices across accelerators, memory tiers, scale-up fabrics, and cluster networks. The resulting Cross-layer Heterogeneous System (XHS) design space is difficult to explore: hardware choices change legal task mappings, while rack power, switch radix, cabling, and cost constraints invalidate many candidates. We present CHASE, an application-driven framework that searches physically feasible XHS architectures through the workloads they must execute. CHASE represents candidates as hierarchical typed graphs and rejects designs that violate deployment constraints. It avoids intractable joint hardware-mapping search with a decoupled two-level loop: an inner mapper translates hardware-independent workload DAGs into topology-aware event traces, a calibrated event-driven simulator evaluates each mapping, and an outer telemetry-guided optimizer evolves the hardware graph. We evaluate CHASE on sparse-computing and LLM workloads. Its mapper remains within 6.06% of exhaustive optima while reducing mapping time by 60.5% on average relative to PEFT. Compute-model errors average 4.4-7.5%, and communication validation reproduces key trends across physical platforms. The outer search reaches near-global optima within 64 iterations. End-to-end case studies show that sparse workloads favor criticality-aware heterogeneous pods, whereas LLM inference favors scale-up islands; the resulting designs deliver 6.20$\times$ and 2.12$\times$ geomean speedups, respectively, while reducing cost and power relative to the baselines.

cs.DC

Food-R1: A Unified Multi-Task Food Vision-Language Model with Reinforcement Learning

Recent studies have explored Vision-Language Models (VLMs) for food analysis. However, most existing methods rely primarily on supervised fine-tuning (SFT), which often limits reasoning and generalization capabilities. Moreover, high-quality large-scale nutritional annotations remain scarce. To address these issues, we introduce CalorieBench-80K, a large-scale benchmark with curated calorie labels and dietary advice annotations. To the best of our knowledge, it is the first food image benchmark to incorporate Chain-of-Thought (CoT) annotations for calorie reasoning. We also propose Food-R1, a unified food VLM trained in a multi-task learning paradigm to equip the model with broad capabilities. Food-R1 undergoes CoT-based cold-start instruction tuning, followed by reinforcement fine-tuning (RFT) using Group Relative Policy Optimization (GRPO) to improve reasoning and performance. Experiments on CalorieBench-80K and representative benchmarks show that Food-R1 consistently outperforms strong baselines across food-related tasks. The code, model weights, and benchmark annotations are available at the project repository.

cs.CV

On extremal cross $t$-intersecting families with $t$-covering number conditions

Let $n$, $k$ and $t$ be positive integers, and let $\mathcal{F}$ be a collection of $k$-subsets of $[n]=\{1,2,\dots,n\}$. The $t$-covering number $\tau_t(\mathcal{F})$ of $\mathcal{F}$ is defined as the minimum size of a set $T$ such that $|F\cap T|\geq t$ for all $F\in \mathcal{F}$. For positive integers $k_1$ and $k_2$, let $\mathcal{F}_i$ be a collection of $k_i$-subsets of $[n]$ for $i\in \{1,2\}$. The families $\mathcal{F}_1$ and $\mathcal{F}_2$ are said to be cross $t$-intersecting if $|F_1\cap F_2|\geq t$ for all $F_1\in\mathcal{F}_1$ and $F_2\in \mathcal{F}_2$. When $\mathcal{F}_1=\mathcal{F}_2$, $\mathcal{F}_1$ is called a $t$-intersecting family. In this paper, we first characterize the extremal structures of cross $t$-intersecting families $\mathcal{F}_1$ and $\mathcal{F}_2$ that maximize $|\mathcal{F}_1||\mathcal{F}_2|$ under the condition that $\tau_t(\mathcal{F}_1)\geq t+1$ and $\tau_t(\mathcal{F}_2)\geq t+1$. We then describe the maximal $t$-intersecting families with $t$-covering number $t+1$.

math.CO

ObjectCache: Layerwise Object-Storage Retrieval for KV Cache Reuse

Prefix KV caching has become a key mechanism in LLM serving: it reduces time to first token (TTFT) by avoiding redundant computation across requests that share a prefix (i.e., the system prompt). However, the accumulated KV cache is often larger than what GPU memory and local DRAM can hold. To preserve latency, current systems keep the KV cache in remote DRAM pools, increasing serving-cluster size and cost. In this paper, we explore a different approach: storing the KV cache in S3-compatible object storage so that capacity is no longer the constraint, while minimizing the impact on TTFT. We propose ObjectCache, which co-designs the storage protocol and transfer schedule so that the storage server delivers KV cache data in the order the GPU consumes it, overlapping data transfer with compute across concurrent requests. We prototype ObjectCache on a 100 Gbps RoCE cluster with NIXL (an inference library that abstracts storage and memory), Ceph RGW (an Object Gateway for clusters), and DAOS (an open source storage system). For 64K contexts, common in today's systems, ObjectCache adds only 5.6\% latency over local DRAM; for 4K contexts, where less compute is available to mask transfer, ObjectCache adds 56--75\,ms over the optimal local layerwise baseline. Under shared bandwidth caps, our scheduler reduces added TTFT by 1.2--1.8x compared with equal bandwidth sharing.

cs.DC

MatterSim-MT: A multi-task foundation model for in silico materials characterization

Accurate property characterization is a major bottleneck in materials design. While first-principles methods and task-specific machine-learning models have driven important progress, they remain fundamentally limited in scalability and generalizability across the vast space of structures and properties relevant to real-world materials design. We present MatterSim-MT, a multi-task foundation model for in silico materials simulation and property characterization. The model is pretrained on over 35 million first-principles-labeled structures covering 89 elements, temperatures up to 5000 K and pressures up to 1000 GPa, and is fine-tuned on various properties including Bader charges, magnetic moments, Born effective charges, and dielectric matrices. Out of the box, MatterSim-MT not only serves as a foundation model for predicting material structure, dynamics and thermodynamics, its multi-task architecture also enables a wide range of complex simulations that cannot be captured by potential energy surfaces alone. For example, we demonstrate pressure-dependent LO-TO phonon splitting in SiC with close agreement with experiment, electric hysteresis in ferroelectric BaTiO3, and the cationic-to-anionic redox transition during delithiation of a Li-rich cathode material. Finally, we show that MatterSim-MT scales well with more data and parameters, can be efficiently fine-tuned to higher levels of theory, and can be efficiently extended to new systems via active learning. Overall, we believe this approach provides a scalable route to accurate in silico materials characterization.

cond-mat.mtrl-sci

QLLVM: A Scalable Quantum-Classical Co-Compilation Framework based on LLVM

To address the urgent need in the NISQ era for high-performance, scalable quantum compilers and to advance the integration of classical and quantum computing, we present QLLVM, an advanced Quantum-Classical co-compilation framework built on LLVM. To our knowledge, QLLVM delivers an end-to-end, LLVM-based compilation workflow that unifies the build of classical high-performance programs, including CUDA, MPI, and C++, together with quantum programs into a single executable. For quantum program compilation, QLLVM adopts a three-stage design: high-level optimizations are implemented in the MLIR Quantum dialect and then lowered to QIR, an LLVM IR-based representation, for low-level optimization and hardware mapping. Its extensible architecture and seamless interoperability with classical high-performance computing provide an efficient, flexible, industrial-grade compilation infrastructure for future quantum software development. Experimental results show that, on the MQTBench benchmark suite, QLLVM reduces circuit depth and gate counts compared with state-of-the-art compilers and demonstrates clear advantages in compiling hybrid classical-quantum programs.

quant-ph

NeuroFlow: Toward Unified Visual Encoding and Decoding from Neural Activity

Visual encoding and decoding models act as gateways to understanding the neural mechanisms underlying human visual perception. Typically, visual encoding models that predict brain activity from stimuli and decoding models that reproduce stimuli from brain activity are treated as distinct tasks, requiring separate models and training procedures. This separation is inefficient and fails to model the consistency between encoding and decoding processes. To address this limitation, we propose NeuroFlow, the first unified framework that jointly models visual encoding and decoding from neural activity within a single flow model. NeuroFlow introduces two key components: (1) NeuroVAE is designed as a variational backbone to model neural variability and establish a compact, semantically structured latent space for bidirectional modeling across visual and neural modalities. (2) Cross-modal Flow Matching (XFM) bypasses the typical paradigm of noise-to-data diffusion guided by a specific modality condition, instead learning a reversibly consistent flow model between visual and neural latent distributions. For the first time, visual encoding and decoding are reformulated as a time-dependent, reversible process within a shared latent space for unified modeling. Empirical results demonstrate that NeuroFlow achieves superior overall performance in visual encoding and decoding tasks with higher computational efficiency compared to any isolated methods. We further analyze principal factors that steer the model toward encoding-decoding consistency and, through brain functional analyses, demonstrate that NeuroFlow captures consistent activation patterns underlying neural variability. NeuroFlow marks a major step toward unified visual encoding and decoding from neural activity, providing mechanistic insights that inform future bidirectional visual brain-computer interfaces.

cs.LG

KappaFormer: Physics-aware Transformer for lattice thermal conductivity via cross-domain transfer learning

Machine learning has been widely used for predicting material properties. However, efficient prediction of lattice thermal conductivity ($\kappa_\mathrm{L}$) remains a long-standing challenge, primarily due to the scarcity of high-quality training data. Here we introduce KappaFormer, a physics-aware Transformer architecture that embeds the harmonic-anharmonic decomposition of $\kappa_\mathrm{L}$ within the network. KappaFormer comprises a harmonic branch pre-trained on large-scale elastic property data and an anharmonic branch fine-tuned on limited experimental $\kappa_\mathrm{L}$ data, enabling effective knowledge transfer and enhanced generalization. High-throughput screening with KappaFormer identifies multiple candidates with ultralow $\kappa_\mathrm{L}$, which are further confirmed by first-principles calculations. Physics interpretability further elucidates the vibrational mechanisms governing thermal transport suppression, linking structural motifs to strong anharmonicity. This study provides a generalizable framework for physics-guided machine learning to accelerate the discovery of new materials.

cond-mat.mtrl-sci

Unlocking Positive Transfer in Incrementally Learning Surgical Instruments: A Self-reflection Hierarchical Prompt Framework

To continuously enhance model adaptability in surgical video scene parsing, recent studies incrementally update it to progressively learn to segment an increasing number of surgical instruments over time. However, prior works constantly overlooked the potential of positive forward knowledge transfer, i.e., how past knowledge could help learn new classes, and positive backward knowledge transfer, i.e., how learning new classes could help refine past knowledge. In this paper, we propose a self-reflection hierarchical prompt framework that unlocks the power of positive forward and backward knowledge transfer in class incremental segmentation, aiming to proficiently learn new instruments, improve existing skills of regular instruments, and avoid catastrophic forgetting of old instruments. Our framework is built on a frozen, pre-trained model that adaptively appends instrument-aware prompts for new classes throughout training episodes. To enable positive forward knowledge transfer, we organize instrument prompts into a hierarchical prompt parsing tree with the instrument-shared prompt partition as the root node, n-part-shared prompt partitions as intermediate nodes and instrument-distinct prompt partitions as leaf nodes, to expose the reusable historical knowledge for new classes to simplify their learning. Conversely, to encourage positive backward knowledge transfer, we conduct self-reflection refining on existing knowledge by directed-weighted graph propagation, examining the knowledge associations recorded in the tree to improve its representativeness without causing catastrophic forgetting. Our framework is applicable to both CNN-based models and advanced transformer-based foundation models, yielding more than 5% and 11% improvements over the competing methods on two public benchmarks respectively.

cs.CV

Analysis of Hydrogen Contamination in Al/AlOx/Al Josephson Junctions

Hydrogen contamination in Josephson junctions is a potential source of device-to-device variability and two-level-system loss in superconducting qubits. In this work, we investigate hydrogen incorporation in oxidized aluminum barriers by combining molecular dynamics simulations with atomistic quantum transport calculations. The oxide growth simulations are performed using CHGNet for Al surfaces exposed to dense O$_{\text{2}}$ and H$_{\text{2}% }$O environments, yielding amorphous AlO$_{\text{x}}$ layers with hydrogen content comparable to experimentally relevant levels. From $400$ statistically independent samples, we find that the number of H atoms in the oxide is well described by a beta-binomial distribution, reflecting correlations induced by the self-limiting oxidation process. Structural analysis shows that most hydrogen atoms reside near the AlO$_{\text{x}}$ surface and predominantly form Al-OH and Al-OH-Al motifs. To assess the impact of hydrogen on transport, we construct Al/Al$_{\text{2}}$O$_{\text{3}} $/Al junction models and perform NEGF-DFT calculations with NanoDCAL, using a GGA+U scheme to calibrate the band gap and band alignment. H atoms are found to increase the transmission coefficient near the Fermi level and shift the electronic structure in a manner consistent with effective p-type doping. By combining the H atom number statistics from molecular dynamics with the transmission coefficients from quantum transport calculations, we obtain a probability distribution for the Josephson energy. For a Josephson junction with an average hydrogen content of $2.56$ at.\%, the resulting Josephson energy is predicted to be $% E_{J}/h=10.92\pm 0.26$ GHz. These results provide an atomistic picture of hydrogen contamination and an estimate of device variability in Josephson junctions.

quant-ph

First-principles predictions of band alignment in strained Si/Si1-xGex and Ge/Si1-xGex heterostructures

Accurate band offsets are essential for predictive continuum modeling of nanostructures such as quantum wells and quantum dots formed in strained Si/Si1-xGex and Ge/Si1-xGex heterostructures. Experimental offset data for these systems remain sparse away from endpoint compositions, making composition-dependent design difficult. We use atomistic first-principles density functional theory to compute valence- and conduction-band offsets across the full range 0 <= x <= 1. Random alloying is treated with special quasirandom structures, interface lineup terms are extracted from macroscopically averaged local Kohn-Sham potentials in thick periodic superlattices, valence-band spin-orbit coupling is included through species-resolved Mulliken weights, and conduction-band edges are refined using the screened hybrid Heyd-Scuseria-Ernzerhof functional. The resulting offsets show pronounced composition nonlinearity beyond the linear models explored in previous works, agree with experimental benchmarks, and reproduce the high-Ge slope change in the relaxed-alloy band gap. Analytic fitting expressions are provided for direct use in simulations, facilitating practical design of modern quantum technology devices.

cond-mat.mes-hall