Chengqian Zhang, Yucheng Jin, Duo Zhang, Tiejun Li, Han Wang
Crystal generative models mainly learn what stable crystals look like, with little explicit supervision for what makes them stable. We reveal a substantial representation gap between state-of-the-art crystal generative models and pretrained universal machine learning interatomic potentials (MLIPs) via energy probing, and show this gap can be closed by a simple training-time alignment. We propose Crystal REPresentation Alignment (CrystalREPA), a plug-and-play framework that aligns the atom-wise hidden states of generative encoders with frozen MLIP representations through an element-aware contrastive objective, transferring stability-aware atomistic priors with marginal training overhead and no additional inference cost. Across three generative frameworks, ten MLIP teachers, and two benchmark datasets, CrystalREPA consistently improves the thermodynamic stability, structural validity, and structural fidelity of generated crystals. Equally important, we find that an MLIP's transfer effectiveness is poorly predicted by its accuracy on standard leaderboards (e.g., Matbench Discovery) but strongly predicted by the distinguishability of its atom-wise representation space, yielding a practical, accuracy-independent criterion for selecting MLIP teachers for generative transfer. Code is available at https://github.com/Chengqian-Zhang/CrystalREPA.
Environmental noise identification is essential for noise control, yet conventional single-stage classifiers suffer from class confusion under imbalanced multiclass conditions. This paper proposes a lightweight hierarchical model integrating a Frequency-Time Adaptive Network (FTANet) with a two-stage classification mechanism. FTANet employs parallel asymmetric one-dimensional convolutions to capture temporal dynamics and frequency-band distributions, while adaptive fusion attention (AFA) enhances discriminative acoustic features. In the first stage, FTANet classifies sounds into five coarse-grained categories covering 25 fine-grained classes. In the second stage, samples are routed to the corresponding category-specific classifiers for fine-grained recognition. On a self-constructed dataset, FTANet achieves 95.45% coarse-grained accuracy with only 0.2004M parameters. On UrbanSound8K, it achieves 79.24% mean accuracy and 80.37% mean F1-score in ten-fold evaluation, outperforming compared convolutional models. Field tests on the Tianjin Online Acoustic Environment Monitoring Platform yield 87.94% coarse-grained accuracy and 97.21% conditional fine-grained accuracy for natural sounds correctly routed to C2. The complete hierarchical model achieves 87.18% overall accuracy and 87.40% weighted-average F1-score, demonstrating its feasibility for urban environmental noise monitoring.
Zhanwei Wu, Jianhao Su, Brian Zhang, ShengTing Huang, Weidong Feng, Gang Liu, Zhiguo Li, Wei Huang 等 14 位作者
Deploying and optimizing a PyTorch inference project on a dedicated accelerator, especially an on-device NPU, requires more than using a framework device API as with CUDA. The project must be converted into hardware-runtime artifacts and adapted to the target toolchain and application interface. Differences in model formats, quantization flows, operator support, and toolchain interfaces create cross-layer problems spanning PyTorch/ONNX models, toolchains, runtimes, and device execution. LLM Agents can invoke tools to address such problems, but may drift because of insufficient domain knowledge, large configuration and repair spaces, or poor path selection. We propose AIPC (AI Porting & Conversion), an Agent method for deploying PyTorch inference projects. AIPC combines structured Skills with toolchain, runtime, and profiling evidence to drive cross-layer diagnosis and repair, organizing model adaptation, artifact building, on-target execution, accuracy repair, and performance optimization into one deployment flow. We evaluate AIPC on the on-device NPU path of Qualcomm QAIRT across vision, speech, LLM, and diffusion models. In two optimization cases, 6/7 Skill-arm Whisper-Small runs meet predefined accuracy and latency criteria versus 0/6 control runs, while YOLO-Worldv2 achieves a 2.791x end-to-end speedup versus 1.599x for the control. Under a pre-fixed deployment contract, Skill, tool permissions, and check conditions, some runs achieve zero in-run human intervention (0-HITL). We also examine Qwen3.8-27B as a locally deployable model for driving an Agent workflow.
This work proposes a self-attention mechanism based on the fully connected quantum Boltzmann machine (FC-QBM), and further constructs a fully connected quantum Boltzmann machine language model (FC-QBM-LM) using the mechanism as the core engine. By performing unitary evolution on semantic quantum states, the mechanism implicitly implements positional encoding and self-attention computation, eliminating the need to decompose continuous semantic streams into discrete matrices for explicit matrix multiplication, with the measurement results naturally satisfying the normalization condition. Specifically, this work rigorously derives the computational principle of the self-attention mechanism based on FC-QBM, and demonstrates that this mechanism is mathematically equivalent to the classical self-attention mechanism. The mathematical principles governing the training and generation of FC-QBM-LM are thoroughly derived, and the two corresponding algorithms are subsequently developed. An 8-qubit FC-QBM-LM is finally constructed and trained on the corpus of Tang poetry. Under the 8-qubit setting, the quantum layer implements the entire positional encoding and self-attention computation pipeline with only 44 parameters. In the noiseless scenario, the model exhibits favorable convergence. Furthermore, the quantum circuit proposed in this work, which terminates with Y-axis rotation gates, achieves better convergence than the counterpart terminating with X-axis rotation gates. Under the small-sample regime and across eight distinct noise intensity levels, the model demonstrates strong noise robustness, retaining over 99% of its noiseless convergence performance. Experiments on five-character quatrain generation reveal that the model preliminarily exhibits three core capabilities: associative and divergent thinking, content generation across imagery and human-aligned word ordering.