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- magconfig-design Public
A priori analysis of the linear independence of neighbor-shell contributions for reliable extraction of Heisenberg exchange parameters from magnetic configurations.
- PseudoDojo-verification-scripts Public
scripts for eos-workflow to verificate PseudoDojo ONCVPSP pseudopotentials. It contains generation, verification, and parser parts.
- eos-workflow Public
A atomate2 workflow to test the convergency and EOS behavior of norm-conserving pseudopotential in PseudoDojo
- LFYKI1102 Public
Dépôt contenant les notebooks Python du cours LFYKI1102 - Physique Statistique et Physique de l'État Solide I. Ressources pour les étudiants.
- shg-ml-benchmarks Public
- re2fractive Public
- modnet Public Forked from ppdebreuck/modnet
MODNet: a framework for machine learning materials properties
- modnet-matbench Public
Data repository accompanying De Breuck et al., "Robust model benchmarking and bias-imbalance in data-driven materials science: a case study on MODNet"
- jupyter-fireworks-proxy Public archive
This package provides an easy way to launch the webgui interface of Fireworks in a Jupyter notebook environment.
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