FAIRmat-NFDI / nomad-perovskite-solar-cells-database

A NOMAD plugin containing the schema for the Perovskite Solar Cell Database.
https://fairmat-nfdi.github.io/nomad-perovskite-solar-cells-database/
Apache License 2.0
3 stars 1 forks source link

A stand alone schema to generate 'standarized' perovskite compositions #17

Open Pepe-Marquez opened 6 months ago

Pepe-Marquez commented 6 months ago

This would be using the Ions subsection in the perovskite section. For this we would need to have suggestions to the ions schema.

Ideally, we could check the charge balance of the final formula. We can do possibly this by using SMACT.