3 papers
cs.AI2026
Large language model agents accelerate inverse design of metal-organic frameworks for gas separation
Zhaolin Hu, Hehe Fan, Wangyihan Guo +4
Metal-organic frameworks (MOFs) offer a highly modular platform for adsorptive gas separation, yet their vast reticular design space makes inverse design difficult under simultaneo…
cs.CE2026
OSCAgent: Accelerating the Discovery of Organic Solar Cells with LLM Agents
Zhaolin Hu, Zhiliang Wu, Kun Li +2
Organic solar cells (OSCs) hold great promise for sustainable energy, but discovering high-performance materials is time-consuming and costly. Existing molecular generation methods…
cs.CV2026
GraphTARIF: Linear Graph Transformer with Augmented Rank and Improved Focus
Zhaolin Hu, Kun Li, Hehe Fan +1
Linear attention mechanisms have emerged as efficient alternatives to full self-attention in Graph Transformers, offering linear time complexity. However, existing linear attention…