Pinned

1. SMACT SMACT Public

   Python package to aid materials design and informatics

   Python 77 22

2. PDynA PDynA Public

   Python package to analyse the structural dynamics of perovskites

   Python 25 1

3. ElementEmbeddings ElementEmbeddings Public

   Python package to interact with high-dimensional representations of the chemical elements

   Python 26

4. CarrierCapture.jl CarrierCapture.jl Public

   Julia package to compute trap-assisted electron and hole capture in semiconductors

   Jupyter Notebook 45 22

5. MacroDensity MacroDensity Public

   Python package to analyse electron density & electrostatic potential grids

   Python 80 44

6. PyTASER PyTASER Public

   Python package to simulate differential absorption spectra of crystals from first principles

   Python 24 4