# materialyzeai/matcalc

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146 stars · 35 forks · Python · BSD-3-Clause

## Links

- GitHub: https://github.com/materialyzeai/matcalc
- Homepage: http://matcalc.ai/
- awesome-repositories: https://awesome-repositories.com/repository/materialyzeai-matcalc.md

## Description

A python library for calculating materials properties from the PES

## Tags

### Part of an Awesome List

- [Interatomic Potentials](https://awesome-repositories.com/f/awesome-lists/ai/interatomic-potentials.md) — Calculates material properties from potential energy surfaces.