What are the key features of MatterGen?
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Answers ( 1 )
MatterGen's key features include:
- Unconditional generation of material candidates.
- Conditional generation based on target property values such as bulk modulus, chemical system, or magnetic density.
- Fine-tuning for various property constraints.
- Use of a diffusion model to predict atomic fractional coordinates, elements, and unit cell lattice vectors.
- Generation of stable, unique, and novel (S.U.N.) materials.
- Structures closer to DFT local energy minima.