Published December 17, 2024 | Version v1

Electronic and optical excitations of K-Sb and Na-Sb crystals

  • 1. ROR icon Carl von Ossietzky Universität Oldenburg

Description

This dataset contains results from DFT, G0W0 and BSE for 8 different alkali-antimony crystals.

All calculations were performed with the code 'exciting'. Larger intermediate files are excluded to reduce the file size, but can be reproduced with the available input files.

The dataset belongs to the identically named publication. Further computational details are available there.

Files

exciting_calc_K_Sb_crystals.zip

Files (1.9 GB)

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