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Fine-Tuned Language Models Generate Stable Inorganic Materials as Text
NYU, ICLR 2024
Theme:Material Generation
微调大型语言模型以生成稳定的材料
将晶体结构【crystal lattice,原子类型及坐标(Fractional coordinates / 3D coordinates)】编码为换行字符串并与文本指令相结合,然后在基础LLM (LLaMA-2)上执行参数高效微调(PEFT)
评估指标:
实验结果:
Gruver N, Sriram A, Madotto A, et al. Fine-Tuned Language Models Generate Stable Inorganic Materials as Text[J]. arXiv preprint arXiv:2402.04379, 2024.
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