Preprint
Sep 2026
SALTED: a symmetry-adapted machine-learning program for predicting electron-densities in molecules and materials
SALTED provides an open-source Python package for machine learning the quantum-mechanical electron density in molecular and condensed-phase systems based on input atomic coordinates and species, based on a linear atom-centered decomposition of the electron density.
Zekun Lou, Alan M. Lewis, T. Bernhard et al.
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