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Zhi Hong

Publications and source records attributed to Zhi Hong.

At least 19 recordsLinked to original sources

Cost-Aware Multi-Objective Bandits: Theory and Application to Budgeted LLM Configuration Evaluation

Large language model (LLM) configuration evaluation is challenging due to limited evaluation budgets, varying costs, and multiple competing objectives. In this paper, we formulate LLM configuration evaluation as a cost-aware multi-objective bandit problem, where each configuration evaluation incurs a configuration-dependent cost and yields a noisy vector-valued outcome. Under this framework, we study two fundamental problems: online configuration selection and Pareto configuration identification. For online configuration selection, we propose a hypervolume-based UCB algorithm that optimizes an optimistic hypervolume-per-cost index. We establish a budgeted regret bound of order $O\bigl(\sum_{i\ne i^\star}\frac{\log B}{\Delta_i}\bigr)$, where $B$ is the evaluation budget, $i^\star$ is the optimal configuration in terms of hypervolume efficiency, and $\Delta_i$ is the corresponding efficiency gap of configuration $i$. This bound retains the logarithmic budget dependence of classical single-objective budgeted bandits. For fixed-budget Pareto identification, we develop a cost-aware empirical gap elimination algorithm and prove that its error probability is of order $O\bigl(\exp(-\frac{B}{H_{\mu,c}})\bigr)$, where $H_{\mu,c}$ is a cost-aware Pareto identification complexity depending on configuration costs and Pareto classification gaps. This error probability decays exponentially with the evaluation budget and recovers the standard Pareto set identification guarantee when all configuration costs are identical. Experiments on LLM configuration evaluation tasks demonstrate that the proposed framework enables efficient online decision-making and accurate cost-aware Pareto identification under limited budgets.

cs.LG

AgentSpec: Understanding Embodied Agent Scaffolds Through Controlled Composition

LLM agents are increasingly built not as single model calls, but as scaffolded systems that combine reasoning, memory, reflection, action execution, and learning. While such scaffolds often improve performance, they are often embedded in tightly coupled pipelines, making it difficult to isolate component contributions, compare alternative designs, or understand how module interactions shape agent behavior. We introduce AgentSpec, a modular specification framework that represents embodied agents as typed compositions of reusable policy components with standardized interfaces. AgentSpec standardizes the interfaces among perception, memory, reasoning, reflection, action, and optional learning, enabling components to be swapped and recombined under controlled conditions. We instantiate this framework across DeliveryBench, ALFRED, MiniGrid, and RoboTHOR, and analyze reasoning, memory, reflection, and reinforcement-learning modules across model backbones. Our results show that agent performance is governed by scaffold compatibility and interaction effects rather than isolated module strength. In particular, structured multi-granularity memory improves long-horizon state tracking, reasoning and memory interact non-uniformly across environments, reflection trades off correction and cost, and RL-trained policies compose best when optimized with deployment-time scaffold structure. AgentSpec provides a controlled foundation for studying, comparing, and designing composable LLM agents. Our code, baselines and interactive playground are publicly available at https://agentspec-embodied.github.io.

cs.CL

Linear and Neural Dueling Bandits with Delayed Feedback

Contextual dueling bandits form a cornerstone of preference-based decision-making, with critical applications in recommender systems and large language model alignment. However, standard algorithms rely on the idealized assumption of immediate feedback, a condition frequently violated in real-world scenarios such as prompt optimization. This setting introduces a unique theoretical challenge: unlike linear bandits, dueling bandit estimators lack closed-form solutions, rendering naive adaptations of standard weighting techniques biased. To address this, we formalize the problem of Contextual Dueling Bandits with Stochastic Delayed Feedback and propose two novel algorithms: Linear (LDB-DF) and Neural (NDB-DF) Dueling Bandits with Delayed Feedback. Central to our approach is a novel estimator that integrates an Inverse Probability Weighting (IPW) mechanism directly into the loss function, ensuring unbiased correction for delayed or missing feedback. We provide comprehensive theoretical analysis, establishing an O(d*sqrt(T)) regret bound for the linear setting and sub-linear guarantees for the neural setting. Extensive experiments on both simulated and real-world datasets demonstrate the effectiveness of our propose.

cs.LG

MASPOB: Bandit-Based Prompt Optimization for Multi-Agent Systems with Graph Neural Networks

Large Language Models (LLMs) have achieved great success in many real-world applications, especially the one serving as the cognitive backbone of Multi-Agent Systems (MAS) to orchestrate complex workflows in practice. Since many deployment scenarios preclude MAS workflow modifications and its performance is highly sensitive to the input prompts, prompt optimization emerges as a more natural approach to improve its performance. However, real-world prompt optimization for MAS is impeded by three key challenges: (1) the need of sample efficiency due to prohibitive evaluation costs, (2) topology-induced coupling among prompts, and (3) the combinatorial explosion of the search space. To address these challenges, we introduce MASPOB (Multi-Agent System Prompt Optimization via Bandits), a novel sample-efficient framework based on bandits. By leveraging Upper Confidence Bound (UCB) to quantify uncertainty, the bandit framework balances exploration and exploitation, maximizing gains within a strictly limited budget. To handle topology-induced coupling, MASPOB integrates Graph Neural Networks (GNNs) to capture structural priors, learning topology-aware representations of prompt semantics. Furthermore, it employs coordinate ascent to decompose the optimization into univariate sub-problems, reducing search complexity from exponential to linear. Extensive experiments across diverse benchmarks demonstrate that MASPOB achieves state-of-the-art performance, consistently outperforming existing baselines.

cs.LG

Workflow-R1: Group Sub-sequence Policy Optimization for Multi-turn Workflow Construction

The rapid evolution of agentic workflows has demonstrated strong performance of LLM-based agents in addressing complex reasoning tasks. However, existing workflow optimization methods typically formulate workflow synthesis as a static, one-shot code-centric generation problem. This paradigm imposes excessive constraints on the model's coding capabilities and restricts the flexibility required for dynamic problem-solving. In this paper, we present Workflow-R1, a framework that reformulates workflow construction as a multi-turn, natural language-based sequential decision-making process. To resolve the optimization granularity mismatch inherent in such multi-turn interactions, we introduce Group Sub-sequence Policy Optimization (GSsPO). While explicitly tailored to align with the interleaved Think-Action dynamics of agentic reasoning, GSsPO fundamentally functions as a structure-aware RL algorithm generalizable to a broad class of multi-turn agentic sequential decision-making tasks. By recalibrating the optimization unit to the composite sub-sequence, specifically the atomic Think-Action cycle, it aligns gradient updates with the semantic boundaries of these interactions, ensuring robust learning in complex multi-turn reasoning tasks. Through extensive experiments on multiple QA benchmarks, Workflow-R1 outperforms competitive baselines, validating GSsPO as a generalized solution for sequential reasoning and establishing Workflow-R1 as a promising new paradigm for automated workflow optimization.

cs.AI

End-to-end deep learning for superoscillatory subtraction imaging

Breaking the diffraction limit in optical imaging is crucial for resolving subwavelength details in a wide range of applications, where superoscillatory imaging and subtraction imaging are two common strategies for surpassing conventional resolution limits. We propose an end-to-end deep learning framework that integrates superoscillatory focusing and subtraction imaging into a single jointly-optimized vectorial Debye integral neural network pipeline, eliminating the traditional two-step acquisition and manual weighting process. With this end-to-end neural network, we further improve the focusing capability of the system to the sub-100-nm regime, enabling deep-subwavelength imaging resolution.

physics.optics

FedPOB: Sample-Efficient Federated Prompt Optimization via Bandits

The performance of large language models (LLMs) is highly sensitive to the input prompt, making prompt optimization a critical task. However, real-world application is hindered by three major challenges: (1) the black-box nature of powerful proprietary LLMs, (2) the need for high sample efficiency due to query costs, and (3) the desire for privacy-preserving collaboration among multiple users. To address these challenges simultaneously, we introduce a novel framework for sample-efficient federated prompt optimization based on multi-armed bandits (MABs). The MAB framework is uniquely suited for this problem as it is (1) inherently a black-box optimization method, (2) practically sample-efficient, and (3) enables collaborative learning with theoretically guaranteed benefit from more participating agents. We first propose the Federated Prompt Optimization via Bandits (FedPOB) algorithm, a federated variant of the Linear UCB algorithm, where agents collaborate by sharing model parameters instead of raw data. We then extend our approach to the practical setting of comparative user feedback by introducing FedPOB with Preference Feedback (FedPOB-Pref), an efficient algorithm based on federated dueling bandits. Extensive experiments demonstrate that both FedPOB and FedPOB-Pref significantly outperform existing baselines and that their performance consistently improves as more agents participate in the collaboration, validating the effectiveness of our federated approach.

cs.LG

Superoscillation focusing of high-order cylindrical-vector beams

Traditional superoscillation focusing typically requires complex optimization of the incident light field. These complexities may limit the practical application of superoscillation. High-order radially polarized Laguerre-Gaussian beams inherently support superoscillation focusing due to their multi-ring amplitude distribution and 0 ~ \pi phase alternation, which align with the necessary destructive interference mechanisms. In this study, we demonstrate that by adjusting the beam mode order together with the incident beam size, we can easily control the full width at half maximum, field of view, and energy distribution of superoscillation focusing. Moreover, high-order azimuthally polarized vortex-phase Laguerre-Gaussian beams can also achieve superoscillation focusing, offering even better super-resolution effects. The distinct focusing behaviors of their circular components present unique opportunities for applications involving circular dichroism materials.

physics.optics

LLM-based Robot Task Planning with Exceptional Handling for General Purpose Service Robots

The development of a general purpose service robot for daily life necessitates the robot's ability to deploy a myriad of fundamental behaviors judiciously. Recent advancements in training Large Language Models (LLMs) can be used to generate action sequences directly, given an instruction in natural language with no additional domain information. However, while the outputs of LLMs are semantically correct, the generated task plans may not accurately map to acceptable actions and might encompass various linguistic ambiguities. LLM hallucinations pose another challenge for robot task planning, which results in content that is inconsistent with real-world facts or user inputs. In this paper, we propose a task planning method based on a constrained LLM prompt scheme, which can generate an executable action sequence from a command. An exceptional handling module is further proposed to deal with LLM hallucinations problem. This module can ensure the LLM-generated results are admissible in the current environment. We evaluate our method on the commands generated by the RoboCup@Home Command Generator, observing that the robot demonstrates exceptional performance in both comprehending instructions and executing tasks.

cs.RO

Combining Language and Graph Models for Semi-structured Information Extraction on the Web

Relation extraction is an efficient way of mining the extraordinary wealth of human knowledge on the Web. Existing methods rely on domain-specific training data or produce noisy outputs. We focus here on extracting targeted relations from semi-structured web pages given only a short description of the relation. We present GraphScholarBERT, an open-domain information extraction method based on a joint graph and language model structure. GraphScholarBERT can generalize to previously unseen domains without additional data or training and produces only clean extraction results matched to the search keyword. Experiments show that GraphScholarBERT can improve extraction F1 scores by as much as 34.8\% compared to previous work in a zero-shot domain and zero-shot website setting.

cs.IR

14 Examples of How LLMs Can Transform Materials Science and Chemistry: A Reflection on a Large Language Model Hackathon

Large-language models (LLMs) such as GPT-4 caught the interest of many scientists. Recent studies suggested that these models could be useful in chemistry and materials science. To explore these possibilities, we organized a hackathon. This article chronicles the projects built as part of this hackathon. Participants employed LLMs for various applications, including predicting properties of molecules and materials, designing novel interfaces for tools, extracting knowledge from unstructured data, and developing new educational applications. The diverse topics and the fact that working prototypes could be generated in less than two days highlight that LLMs will profoundly impact the future of our fields. The rich collection of ideas and projects also indicates that the applications of LLMs are not limited to materials science and chemistry but offer potential benefits to a wide range of scientific disciplines.

cond-mat.mtrl-sci

The Diminishing Returns of Masked Language Models to Science

Transformer-based masked language models such as BERT, trained on general corpora, have shown impressive performance on downstream tasks. It has also been demonstrated that the downstream task performance of such models can be improved by pretraining larger models for longer on more data. In this work, we empirically evaluate the extent to which these results extend to tasks in science. We use 14 domain-specific transformer-based models (including ScholarBERT, a new 770M-parameter science-focused masked language model pretrained on up to 225B tokens) to evaluate the impact of training data, model size, pretraining and finetuning time on 12 downstream scientific tasks. Interestingly, we find that increasing model sizes, training data, or compute time does not always lead to significant improvements (i.e., >1% F1), if at all, in scientific information extraction tasks and offered possible explanations for the surprising performance differences.

cs.CL

Broadband Cross-Circular Polarization Carpet Cloaking based on a Phase Change Material Metasurface in the Mid-infrared Region

In view of the fact that most invisibility devices focus on linear polarization cloaking and that the characteristics of mid infrared cloaking are rarely studied, we propose a cross circularly polarized invisibility carpet cloaking device in the mid infrared band. Based on the Pancharatnam Berry phase principle, the unit cells with the cross circular polarization gradient phase were carefully designed and constructed into a metasurface. In order to achieve tunable cross circular polarization carpet cloaks, a phase change material is introduced into the design of the unit structure. When the phase change material is in amorphous and crystalline states, the proposed metasurface unit cells can achieve high efficiency cross polarization conversion and reflection intensity can be tuned. According to the phase compensation principle of carpet cloaking, we construct a metasurface cloaking device with a phase gradient using the designed unit structure. From the near and far field distributions, the cross circular polarization cloaking property is confirmed in the broadband wavelength range. The proposed cloaking device can effectively resist detection of cross-circular polarization.

physics.optics

AI- and HPC-enabled Lead Generation for SARS-CoV-2: Models and Processes to Extract Druglike Molecules Contained in Natural Language Text

Researchers worldwide are seeking to repurpose existing drugs or discover new drugs to counter the disease caused by severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2). A promising source of candidates for such studies is molecules that have been reported in the scientific literature to be drug-like in the context of coronavirus research. We report here on a project that leverages both human and artificial intelligence to detect references to drug-like molecules in free text. We engage non-expert humans to create a corpus of labeled text, use this labeled corpus to train a named entity recognition model, and employ the trained model to extract 10912 drug-like molecules from the COVID-19 Open Research Dataset Challenge (CORD-19) corpus of 198875 papers. Performance analyses show that our automated extraction model can achieve performance on par with that of non-expert humans.

cs.CL

Free Control of Far-Field Scattering Angle of Transmission Terahertz Wave using Multilayer Split-Ring Resonators Metasurfaces

To enhance transmission efficiency of Pancharatnam-Berry (PB) phase metasurfaces, multilayer split-ring resonators were proposed to develop encoding sequences. As per the generalized Snell law, the deflection angle of the PB phase encoding metasurfaces depends on the metasurface period size. Therefore, it is impossible to design an infinitesimal metasurface unit.Consequently, the continuous transmission scattering angle cannot be obtained. In digital signal processing, this study introduces the Fourier convolution principle on encoding metasurface sequences to freely control the transmitted scattering angles. Both addition and subtraction operations between two different encoding sequences were then performed to achieve the continuous variation of the scattering angle. Furthermore, we established that the Fourier convolution principle can be applied to the checkerboard coded metasurfaces.

physics.optics

Targeting SARS-CoV-2 with AI- and HPC-enabled Lead Generation: A First Data Release

Researchers across the globe are seeking to rapidly repurpose existing drugs or discover new drugs to counter the the novel coronavirus disease (COVID-19) caused by severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2). One promising approach is to train machine learning (ML) and artificial intelligence (AI) tools to screen large numbers of small molecules. As a contribution to that effort, we are aggregating numerous small molecules from a variety of sources, using high-performance computing (HPC) to computer diverse properties of those molecules, using the computed properties to train ML/AI models, and then using the resulting models for screening. In this first data release, we make available 23 datasets collected from community sources representing over 4.2 B molecules enriched with pre-computed: 1) molecular fingerprints to aid similarity searches, 2) 2D images of molecules to enable exploration and application of image-based deep learning methods, and 3) 2D and 3D molecular descriptors to speed development of machine learning models. This data release encompasses structural information on the 4.2 B molecules and 60 TB of pre-computed data. Future releases will expand the data to include more detailed molecular simulations, computed models, and other products.

q-bio.BM

Analogue of electromagnetically induced transparency with high Q factor in Metal-dielectric metamaterials

We investigated numerically the electromagnetically induced transparency (EIT) behavior with the maximum Q factor is up to 28000 in a metal-dielectric metamaterial. It composed of two layers, a metallic strip as bright mode stacked above a dielectric rod as another bright mode. The coherent coupling between the broad electric dipole induced by the metal strip and the narrow toroidal dipole induced by the dielectric rod leads to the destructive interference, then introduces a transparency window. Interestingly, the EIT window could be effectively influenced by varying parameters of the two layers and the thickness of middle spacer. This process can be explained by using two-particle model. Furthermore, the radiation loss is greatly suppressed within the EIT windows and the slow light effect is improved a lot. These excellent properties also provide an effective platform for the filters and sensitive chemical and biological sensors in the optical range.

physics.optics

AstroCloud: A Distributed Cloud Computing and Application Platform for Astronomy

Virtual Observatory (VO) is a data-intensively online astronomical research and education environment, which takes advantages of advanced information technologies to achieve seamless and global access to astronomical information. AstroCloud is a cyber-infrastructure for astronomy research initiated by Chinese Virtual Observatory (China-VO) project, and also a kind of physical distributed platform which integrates lots of tasks such as telescope access proposal management, data archiving, data quality control, data release and open access, cloud based data processing and analysis. It consists of five application channels, i.e. observation, data, tools, cloud and public and is acting as a full lifecycle management system and gateway for astronomical data and telescopes. Physically, the platform is hosted in six cities currently, i.e. Beijing, Nanjing, Shanghai, Kunming, Lijiang and Urumqi, and serving more than 17 thousand users. Achievements from international Virtual Observatories and Cloud Computing are adopted heavily. In the paper, backgrounds of the project, architecture, Cloud Computing environment, key features of the system, current status and future plans are introduced.

astro-ph.IM