JOSS Papers: Computational Materials Science

All Papers
2412
 Published Papers
2161
 Active Papers
251
published Published about 2 months ago

Lightshow: a Python package for generating computational x-ray absorption spectroscopy input files

Python Jupyter Notebook
@matthewcarbone
10.21105/joss.05182
published Published 4 months ago

spgrep: On-the-fly generator of space-group irreducible representations

Python
@lan496
10.21105/joss.05269
published Published 12 months ago

smol: A Python package for cluster expansions and beyond

Python Cython
@lbluque
10.21105/joss.04504
published Published 12 months ago

solid_dmft: gray-boxing DFT+DMFT materials simulations with TRIQS

PHP
@the-hampel
10.21105/joss.04623
published Published over 2 years ago

GIMS: Graphical Interface for Materials Simulations

Python JavaScript
@kokookster
10.21105/joss.02767
published Published about 4 years ago

Basicsums: A Python package for computing structural sums and the effective conductivity of random composites

Python
@wojciech-n
10.21105/joss.01327
Displaying 6 papers

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ISSN 2475-9066