Measuring the similarity between materials
Focusing on a specific physical property, we aim to develop a method for measuring the similarity between materials from the viewpoint of the underlying mechanisms that work in these materials.
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The representation of potential energy surfaces
Proposing a chemical-structure-dependent linear mixture model for estimating the atomic potential energy
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The structure-property relationship in crystalline materials
Developing a descriptor named Orbital Field Matrix (OFM) for representing material structures in datasets of multi-element materials
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