MatCompGenAI
Generating Material Compositions from Desired Properties
Describe the material you want and let MatCompGenAI generate novel inorganic materials or predict material properties in seconds.
MatCompGenAIWhat is MatCompGenAI?
MatCompGenAI is an AI-powered inverse design tool that generates novel inorganic crystalline material compositions based on target properties. Designed for rapid materials discovery, it supports research and development in materials science and engineering.
MatCompGenAIWhat Will You Discover?
Things to Try
Generate a novel non-magnetic material characterized by a formation energy of approximately -2 eV/atom, a bandgap of 1.3 eV, and high thermodynamic stability.
I want a stable material with formation energy -1.5 eV/atom and volume about 12 ų/atom.
Give me a metal with low energy per atom around -4 eV. Non-magnetic preferred.
I just need an insulator. No need to specify anything else.
Looking for a narrow-gap semiconductor with a bandgap close to 0.5 eV. Should be stable with formation energy about -1.2 eV/atom and moderately dense, say around 12 ų/atom.
Can you generate a material with band gap between 500 meV and 1000 meV, volume 10 ų/atom, and energy above hull < 50 meV/atom?
I've been using BaTiO3 for my research and need to increase its volume per atom to 20 A^3/atom.
I am conducting research on ceramic materials. Could you calculate the material properties of Al2O3?
Give me a non-magnetic metal with low energy per atom (about -5.2 eV) and high thermodynamic stability.