Bispectrum degenerate B8 data

DOI10.5281/zenodo.8003294Zenodo8003294MaRDI QIDQ6724619

Dataset published at Zenodo repository.

Author name not available (Why is that?)

Publication date: 4 June 2023

Dataset of 4000 pairs of bispectrum degenerate boron (B8) structures, along with scripts to generate the atom-centered (nu=7) and three-centered features that are complete. Also contains scripts to reconstruct the nu=7 single-centered features from the three center features using an encoder-decoder architecture, and to model the structural energies using these features

This page was built for dataset: Bispectrum degenerate B8 data