Enhanced Conditional Generation of Double Perovskite by Knowledge-Guided Language Model Feedback

arXiv — cs.LGWednesday, December 3, 2025 at 5:00:00 AM
  • A new framework for generating double perovskite compositions has been introduced, utilizing a multi-agent, text gradient-driven approach that incorporates feedback from large language models (LLMs), domain-specific knowledge, and machine learning surrogates. This innovative method aims to enhance the conditional generation of materials, addressing the challenges posed by the vast design space of double perovskites.
  • The development is significant as it improves the reliability and efficiency of materials discovery in sustainable energy technologies, particularly in the context of double perovskites, which are known for their compositional tunability and low-energy fabrication compatibility.
  • This advancement reflects a growing trend in the integration of AI and machine learning in materials science, highlighting the importance of knowledge-guided approaches in overcoming traditional limitations. The synergy between LLMs and domain-specific insights is becoming increasingly vital for tackling complex challenges in materials and device discovery.
— via World Pulse Now AI Editorial System

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