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Peng Kang

Publications and source records attributed to Peng Kang.

At least 19 recordsLinked to original sources

The energetics of force errors in machine-learned molecular dynamics

The energetic effect of a force error depends on atomic motion. We establish a directional residual-work coefficient combining directional curvature mismatch with the spatial distribution of the residual response. For conservative potentials force-matched at an anchor, it determines the leading signed work at the first crossing of a small force-error budget. At a 474-atom lithium-electrolyte interface, predictions fixed before future reference evaluations differ from measurements by less than 4.6% of predicted work across 24 prescribed endpoints. Changing only the initial velocity direction at fixed structure and initial total kinetic energy reverses the force-work ranking. At the same admitted time of 0.25 fs, one direction gives an 11.6% larger maximum force residual but 36.1% less work. The reversal recurs at a second structure. The framework connects force tolerances to reference-energy transfer, providing a physical basis for potential assessment and adaptive reference allocation.

cond-mat.mtrl-sci

IDMate: Finite-temperature error bounds for window-resolved self-consistent-field screening

We formulate a finite-temperature residual test in IDMate that bounds window-resolved electronic errors without a spectral-gap assumption. For a fixed Hamiltonian and exact electron number, strong convexity of the matrix Fermi entropy bounds the density-matrix distance and free-energy error within a selected window. The bound remains finite at spectral crossings and extends to weighted k points with a shared chemical potential. We also derive a distance correction for particle-number mismatch. Across $3{,}586$ stress trials in $70$ seeded perturbation ladders, $1{,}942$ proposals satisfy the screen with no observed violation of the $0.05$ window-distance criterion plus its numerical allowance. This criterion differs from the uncorrected exact-trace bound, which six of ten historical in-loop candidates exceed at the numerical-error scale. An accept-or-recover loop replaces ten reference-map evaluations while meeting terminal comparison criteria in three configurations that include oracle-subspace controls. Additional candidates built only from preceding-iteration orbitals yield two acceptances and one abstention. The silicon candidate has a window distance of $1.891\times10^{-13}$ but a normalized real-space density error of $3.754\%$. Analytic examples separate errors from complement occupations and interblock coupling. Window-level accuracy therefore does not imply full-state accuracy; the screen tests compressed proposal quality, independently of nonlinear SCF convergence or net acceleration.

cond-mat.mtrl-sci

Exact branch-transfer criterion for common-mode Thomson heat cancellation in thermoelectric couples

Thermoelectric p- and n-type legs are commonly paired by matching their Seebeck magnitudes, although a cooler responds to heat transported through its complete electrical and thermal network. We decompose the leg coefficients into differential thermopower $\alpha=S_p-S_n$ and common thermopower $M=(S_p+S_n)/2$. In a connected steady-state scalar thermoelectric network, a temperature-independent co-shift applied to every electrically active segment is an exact terminal null. A temperature-dependent perturbation of the legs relative to fixed leads is instead physical. At fixed current and shared isothermal endpoints, its first-order cold-port response is the action of $\Gamma_m=T\,dm/dT$ on the difference between the p- and n-branch oriented collection measures. We prove that every continuous $\Gamma_m$ cancels if and only if these measures are equal. In the constant-property, linear-common-mode limit, matching $R_i/K_i^{\rm leg}$ is sufficient and does not require identical legs. One- and two-dimensional calculations confirm the analytic reductions within their stated domains. For split thermal pads, the analysis gives the exact array law $\Delta Q_{c,\Sigma}=\sum_j C_jI_j\Delta T_{c,j}$ and, for series elements with isothermal hot pairs, $I\Delta V_\Sigma=-\Delta Q_{c,\Sigma}$. A representative seven-pair model gives corresponding increments of 7.87 mW and $-2.80$ mV. Branch transfer and endpoint topology therefore provide distinct material-pairing and device-test criteria for common-mode Thomson heat.

cond-mat.mtrl-sci

Broadband phonon-velocity suppression and a finite anisotropic crossover in twisted bilayer SnSe

Moir\'e superlattices reshape lattice dynamics without altering chemical composition, yet how crystal anisotropy modifies this control remains unclear. We combine density-functional-theory (DFT)-calibrated lattice-dynamical calculations with angle-matched untwisted controls to study puckered bilayer SnSe across seven commensurate twist angles ($3.18^\circ$--$8.77^\circ$). At 300 K, twisting suppresses the band-path heat-capacity-weighted mean-square group velocity to 2.6--8.4\% of the control values; the suppression spans a broad frequency range rather than a few soft branches. The velocity response crosses over between $4.78^\circ$ and $3.82^\circ$ into a regime where the relaxed stacking textures and frequency-resolved velocity profiles become self-similar, with the normalized mean-square velocity ratio spanning only 11.1\% of its mean across the three smallest angles---a finite anisotropic crossover, not a singular-angle condition. Direct DFT--MACE force-constant agreement ($r=0.996$), uniform $4\times4\times1$ stability scans, and acoustic-sum-rule and path-density tests support the trend. The equilibrium trend is defined by six structures after excluding one relaxation-sensitive case. These results extend phonon twistronics to low-symmetry layered materials and identify crystal anisotropy as a key determinant of finite-angle phonon crossover behavior.

cond-mat.mtrl-sci

OpenAaaS: An Open Agent-as-a-Service Framework for Distributed Materials-Informatics Research

The Materials Genome Initiative catalyzed the proliferation of centralized platforms--SaaS, PaaS, and IaaS--that aggregate computational and experimental resources for accelerated materials discovery. In parallel, breakthroughs in large language models (LLMs) and autonomous agents have created powerful new reasoning capabilities for scientific research. Yet a critical "last mile" problem remains: while we possess world-class models and vast repositories of materials data, we lack the organizational infrastructure to compose these capabilities securely across institutional boundaries. The development of structural and functional materials for harsh service environments--high-temperature alloys, radiation resistant steels, corrosion-resistant coatings--remains characterized by long-term iteration, mechanistic complexity, and high domain expertise--demands that exceed both monolithic agent systems and traditional centralized platforms. To address this gap we propose OpenAaaS, an open-source hierarchical and distributed Agent-as-a-Service framework that enables organized multi-agent collaboration for intelligent materials design. OpenAaaS is built on a single foundational principle: code flows, data stays still. A Master Agent plans and decomposes complex research tasks without requiring direct access to subordinate agents' managed data and computational resources. Sub-agents, deployed as near-data execution nodes, retain full sovereignty over local datasets, proprietary algorithms, and specialized hardware. This architecture guarantees that raw data never leaves its domain of origin while enabling cross-scale, cross-domain secure integration of previously isolated materials intelligence silos. We validate the framework through two representative case studies: (i) AlphaAgent, an evidence-grounded materials literature analysis executor that achieves 4.66/5.0 on deep analytical questions against single-pass RAG baselines; and (ii) an ultra-large-scale hexa-high-entropy alloy descriptor database service that demonstrates secure near-data execution and domain-specific scientific workflows under strict data-sovereignty constraints. OpenAaaS establishes a principled pathway toward "organized research" via agent collectives, offering a scalable foundation for next-generation materials intelligent design platforms. All source code is available at https://github.com/Wolido/OpenAaaS.

cond-mat.mtrl-sci

Recent Advances in Spatially Coupled Codes: Overview and Outlook

The concept of spatial coupling is among the most significant breakthroughs in coding theory over the past decade. The excellent waterfall and error floor performance of spatially coupled codes has positioned them as promising coding candidates for future communication and data storage systems. This article presents an overview of recent advances in spatially coupled codes. In particular, we first review several representative examples of recently proposed spatially coupled codes and highlight their unique features that make them appealing for different applications. Next, we discuss the useful properties of spatially coupled codes and how to design good spatially coupled codes. The article concludes with some future research directions and open problems.

cs.IT

Skill-Contracted Agents for Evidence-Aware Materials Literature Analysis

Materials science literature analysis requires simultaneous attention to composition, processing, characterization, and property relationships, yet conventional retrieval-augmented generation pipelines struggle to reconcile heterogeneous tasks within a single retrieve-then-generate architecture. Here we present AlphaAgent, a skill-driven agent framework that decouples retrieval-based question answering from paper-level report generation through explicit skill contracts. A dedicated retrieval skill rewrites user requests into material-specific search intents, queries a curated index of more than 300,000 papers from the Journal Citation Reports Metallurgy and Metallurgical Engineering category, and reformulates queries when initial evidence is insufficient. A separate report-generation skill parses full-text PDFs to produce structured per-paper analytical reports and cross-paper summaries. In a blind evaluation on 40 materials-science questions, half of which required deep analytical reasoning, AlphaAgent substantially outperformed a baseline system matched for underlying model, document index, and retrieval scale, with the largest gains in mechanistic explanation and awareness of credibility boundaries. These results indicate that explicit task separation, refined retrieval intent, and evidence-aware generation improve large-language-model-based literature analysis for materials research.

cs.CL

RubricBench: Aligning Model-Generated Rubrics with Human Standards

As Large Language Model (LLM) alignment evolves from simple completions to complex, highly sophisticated generation, Reward Models are increasingly shifting toward rubric-guided evaluation to mitigate surface-level biases. However, the community lacks a unified benchmark to assess this evaluation paradigm, as existing benchmarks lack both the discriminative complexity and the ground-truth rubric annotations required for rigorous analysis. To bridge this gap, we introduce RubricBench, a curated benchmark with 1,147 pairwise comparisons specifically designed to assess the reliability of rubric-based evaluation. Our construction employs a multi-dimensional filtration pipeline to target hard samples featuring nuanced input complexity and misleading surface bias, augmenting each with expert-annotated, atomic rubrics derived strictly from instructions. Comprehensive experiments reveal a substantial capability gap between human-annotated and model-generated rubrics, indicating that even state-of-the-art models struggle to autonomously specify valid evaluation criteria, lagging considerably behind human-guided performance.

cs.AI

Progressive Image Restoration via Text-Conditioned Video Generation

Recent text-to-video models have demonstrated strong temporal generation capabilities, yet their potential for image restoration remains underexplored. In this work, we repurpose CogVideo for progressive visual restoration tasks by fine-tuning it to generate restoration trajectories rather than natural video motion. Specifically, we construct synthetic datasets for super-resolution, deblurring, and low-light enhancement, where each sample depicts a gradual transition from degraded to clean frames. Two prompting strategies are compared: a uniform text prompt shared across all samples, and a scene-specific prompting scheme generated via LLaVA multi-modal LLM and refined with ChatGPT. Our fine-tuned model learns to associate temporal progression with restoration quality, producing sequences that improve perceptual metrics such as PSNR, SSIM, and LPIPS across frames. Extensive experiments show that CogVideo effectively restores spatial detail and illumination consistency while maintaining temporal coherence. Moreover, the model generalizes to real-world scenarios on the ReLoBlur dataset without additional training, demonstrating strong zero-shot robustness and interpretability through temporal restoration.

cs.CV

SplatPose: Geometry-Aware 6-DoF Pose Estimation from Single RGB Image via 3D Gaussian Splatting

6-DoF pose estimation is a fundamental task in computer vision with wide-ranging applications in augmented reality and robotics. Existing single RGB-based methods often compromise accuracy due to their reliance on initial pose estimates and susceptibility to rotational ambiguity, while approaches requiring depth sensors or multi-view setups incur significant deployment costs. To address these limitations, we introduce SplatPose, a novel framework that synergizes 3D Gaussian Splatting (3DGS) with a dual-branch neural architecture to achieve high-precision pose estimation using only a single RGB image. Central to our approach is the Dual-Attention Ray Scoring Network (DARS-Net), which innovatively decouples positional and angular alignment through geometry-domain attention mechanisms, explicitly modeling directional dependencies to mitigate rotational ambiguity. Additionally, a coarse-to-fine optimization pipeline progressively refines pose estimates by aligning dense 2D features between query images and 3DGS-synthesized views, effectively correcting feature misalignment and depth errors from sparse ray sampling. Experiments on three benchmark datasets demonstrate that SplatPose achieves state-of-the-art 6-DoF pose estimation accuracy in single RGB settings, rivaling approaches that depend on depth or multi-view images.

cs.CV

Deep-Learning-Based Adaptive Error-Correction Decoding for Spin-Torque Transfer Magnetic Random Access Memory (STT-MRAM)

Spin-torque transfer magnetic random access memory (STT-MRAM) is a promising emerging non-volatile memory (NVM) technology with wide applications. However, the data recovery of STT-MRAM is affected by the diversity of channel raw bit error rate (BER) across different dies caused by process variations, as well as the unknown resistance offset due to temperature change. Therefore, it is critical to develop effective decoding algorithms of error correction codes (ECCs) for STT-MRAM. In this article, we first propose a neural bit-flipping (BF) decoding algorithm, which can share the same trellis representation as the state-of-the-art neural decoding algorithms, such as the neural belief propagation (NBP) and neural offset min-sum (NOMS) algorithm. Hence, a neural network (NN) decoder with a uniform architecture but different NN parameters can realize all these neural decoding algorithms. Based on such a unified NN decoder architecture, we further propose a novel deep-learning (DL)-based adaptive decoding algorithm whose decoding complexity can be adjusted according to the change of the channel conditions of STT-MRAM. Extensive experimental evaluation results demonstrate that the proposed neural decoders can greatly improve the performance over the standard decoders, with similar decoding latency and energy consumption. Moreover, the DL-based adaptive decoder can work well over different channel conditions of STT-MRAM irrespective of the unknown resistance offset, with a 50% reduction of the decoding latency and energy consumption compared to the fixed decoder.

cs.IT

A Converting Autoencoder Toward Low-latency and Energy-efficient DNN Inference at the Edge

Reducing inference time and energy usage while maintaining prediction accuracy has become a significant concern for deep neural networks (DNN) inference on resource-constrained edge devices. To address this problem, we propose a novel approach based on "converting" autoencoder and lightweight DNNs. This improves upon recent work such as early-exiting framework and DNN partitioning. Early-exiting frameworks spend different amounts of computation power for different input data depending upon their complexity. However, they can be inefficient in real-world scenarios that deal with many hard image samples. On the other hand, DNN partitioning algorithms that utilize the computation power of both the cloud and edge devices can be affected by network delays and intermittent connections between the cloud and the edge. We present CBNet, a low-latency and energy-efficient DNN inference framework tailored for edge devices. It utilizes a "converting" autoencoder to efficiently transform hard images into easy ones, which are subsequently processed by a lightweight DNN for inference. To the best of our knowledge, such autoencoder has not been proposed earlier. Our experimental results using three popular image-classification datasets on a Raspberry Pi 4, a Google Cloud instance, and an instance with Nvidia Tesla K80 GPU show that CBNet achieves up to 4.8x speedup in inference latency and 79% reduction in energy usage compared to competing techniques while maintaining similar or higher accuracy.

cs.LG

Event-based Shape from Polarization with Spiking Neural Networks

Recent advances in event-based shape determination from polarization offer a transformative approach that tackles the trade-off between speed and accuracy in capturing surface geometries. In this paper, we investigate event-based shape from polarization using Spiking Neural Networks (SNNs), introducing the Single-Timestep and Multi-Timestep Spiking UNets for effective and efficient surface normal estimation. Specificially, the Single-Timestep model processes event-based shape as a non-temporal task, updating the membrane potential of each spiking neuron only once, thereby reducing computational and energy demands. In contrast, the Multi-Timestep model exploits temporal dynamics for enhanced data extraction. Extensive evaluations on synthetic and real-world datasets demonstrate that our models match the performance of state-of-the-art Artifical Neural Networks (ANNs) in estimating surface normals, with the added advantage of superior energy efficiency. Our work not only contributes to the advancement of SNNs in event-based sensing but also sets the stage for future explorations in optimizing SNN architectures, integrating multi-modal data, and scaling for applications on neuromorphic hardware.

cs.NE

Boost Event-Driven Tactile Learning with Location Spiking Neurons

Tactile sensing is essential for a variety of daily tasks. And recent advances in event-driven tactile sensors and Spiking Neural Networks (SNNs) spur the research in related fields. However, SNN-enabled event-driven tactile learning is still in its infancy due to the limited representation abilities of existing spiking neurons and high spatio-temporal complexity in the event-driven tactile data. In this paper, to improve the representation capability of existing spiking neurons, we propose a novel neuron model called "location spiking neuron", which enables us to extract features of event-based data in a novel way. Specifically, based on the classical Time Spike Response Model (TSRM), we develop the Location Spike Response Model (LSRM). In addition, based on the most commonly-used Time Leaky Integrate-and-Fire (TLIF) model, we develop the Location Leaky Integrate-and-Fire (LLIF) model. Moreover, to demonstrate the representation effectiveness of our proposed neurons and capture the complex spatio-temporal dependencies in the event-driven tactile data, we exploit the location spiking neurons to propose two hybrid models for event-driven tactile learning. Specifically, the first hybrid model combines a fully-connected SNN with TSRM neurons and a fully-connected SNN with LSRM neurons. And the second hybrid model fuses the spatial spiking graph neural network with TLIF neurons and the temporal spiking graph neural network with LLIF neurons. Extensive experiments demonstrate the significant improvements of our models over the state-of-the-art methods on event-driven tactile learning. Moreover, compared to the counterpart artificial neural networks (ANNs), our SNN models are 10x to 100x energy-efficient, which shows the superior energy efficiency of our models and may bring new opportunities to the spike-based learning community and neuromorphic engineering.

cs.NE

Parity-Check Matrix Partitioning for Efficient Layered Decoding of QC-LDPC Codes

In this paper, we consider how to partition the parity-check matrices (PCMs) to reduce the hardware complexity and computation delay for the row layered decoding of quasi-cyclic low-density parity-check (QC-LDPC) codes. First, we formulate the PCM partitioning as an optimization problem, which targets to minimize the maximum column weight of each layer while maintaining a block cyclic shift property among different layers. As a result, we derive all the feasible solutions for the problem and propose a tight lower bound $\omega_{LB}$ on the minimum possible maximum column weight to evaluate a solution. Second, we define a metric called layer distance to measure the data dependency between consecutive layers and further illustrate how to identify the solutions with desired layer distance from those achieving the minimum value of $\omega_{LB}=1$, which is preferred to reduce computation delay. Next, we demonstrate that up-to-now, finding an optimal solution for the optimization problem with polynomial time complexity is unachievable. Therefore, both enumerative and greedy partition algorithms are proposed instead. After that, we modify the quasi-cyclic progressive edge-growth (QC-PEG) algorithm to directly construct PCMs that have a straightforward partition scheme to achieve $\omega_{LB} $ or the desired layer distance. Simulation results showed that the constructed codes have better error correction performance and smaller average number of iterations than the underlying 5G LDPC code.

cs.IT

Event-Driven Tactile Learning with Location Spiking Neurons

The sense of touch is essential for a variety of daily tasks. New advances in event-based tactile sensors and Spiking Neural Networks (SNNs) spur the research in event-driven tactile learning. However, SNN-enabled event-driven tactile learning is still in its infancy due to the limited representative abilities of existing spiking neurons and high spatio-temporal complexity in the data. In this paper, to improve the representative capabilities of existing spiking neurons, we propose a novel neuron model called "location spiking neuron", which enables us to extract features of event-based data in a novel way. Moreover, based on the classical Time Spike Response Model (TSRM), we develop a specific location spiking neuron model - Location Spike Response Model (LSRM) that serves as a new building block of SNNs. Furthermore, we propose a hybrid model which combines an SNN with TSRM neurons and an SNN with LSRM neurons to capture the complex spatio-temporal dependencies in the data. Extensive experiments demonstrate the significant improvements of our models over other works on event-driven tactile learning and show the superior energy efficiency of our models and location spiking neurons, which may unlock their potential on neuromorphic hardware.

cs.NE

Generalized Mutual Information-Maximizing Quantized Decoding of LDPC Codes with Layered Scheduling

In this paper, we propose a framework of the mutual information-maximizing (MIM) quantized decoding for low-density parity-check (LDPC) codes by using simple mappings and fixed-point additions. Our decoding method is generic in the sense that it can be applied to LDPC codes with arbitrary degree distributions, and can be implemented based on either the belief propagation (BP) algorithm or the min-sum (MS) algorithm. In particular, we propose the MIM density evolution (MIM-DE) to construct the lookup tables (LUTs) for the node updates. The computational complexity and memory requirements are discussed and compared to the LUT decoder variants. For applications with low-latency requirement, we consider the layered schedule to accelerate the convergence speed of decoding quasi-cyclic LDPC codes. In particular, we develop the layered MIM-DE to design the LUTs based on the MS algorithm, leading to the MIM layered quantized MS (MIM-LQMS) decoder. An optimization method is further introduced to reduce the memory requirement for storing the LUTs. Simulation results show that the MIM quantized decoders outperform the state-of-the-art LUT decoders in the waterfall region with both 3-bit and 4-bit precision over the additive white Gaussian noise channels. For small decoding iterations, the MIM quantized decoders also achieve a faster convergence speed compared to the benchmarks. Moreover, the 4-bit MIM-LQMS decoder can approach the error performance of the floating-point layered BP decoder within 0.3 dB in the moderate-to-high SNR regions, over both the AWGN channels and the fast fading channels.

cs.IT

Memory Efficient Mutual Information-Maximizing Quantized Min-Sum Decoding for Rate-Compatible LDPC Codes

In this letter, we propose a two-stage design method to construct memory efficient mutual information-maximizing quantized min-sum (MIM-QMS) decoder for rate-compatible low-density parity-check (LDPC) codes. We first develop a modified density evolution to design a unique set of lookup tables (LUTs) that can be used for rate-compatible LDPC codes. The constructed LUTs are optimized based on their discrepancy values and a merge function to reduce the memory requirement. Numerical results show that the proposed rate-compatible MIM-QMS decoder can reduce the memory requirement for decoding by up to 94.92% compared to the benchmark rate-compatible LUT-based decoder with generally faster convergence speed. In addition, the proposed decoder can approach the performance of the floating-pointing belief propagation decoder within 0.15 dB.

cs.IT