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cond-mat.mtrl-sci2023★ 2 cited
Compositional Representation of Polymorphic Crystalline Materials
Namkyeong Lee, Heewoong Noh, Gyoung S. Na +4
Machine learning (ML) has seen promising developments in materials science, yet its efficacy largely depends on detailed crystal structural data, which are often complex and hard t…
cond-mat.mtrl-sci2023★ 3 cited
Density of States Prediction of Crystalline Materials via Prompt-guided Multi-Modal Transformer
Namkyeong Lee, Heewoong Noh, Sungwon Kim +3
The density of states (DOS) is a spectral property of crystalline materials, which provides fundamental insights into various characteristics of the materials. While previous works…