Published August 15, 2023 | Version v1

Data for "Automated analysis of surface facets: the example of cesium telluride"

  • 1. Carl von Ossietzky Universität Oldenburg, Physics Department, D-26129 Oldenburg, Germany

Description

The AiiDA archives of the high-throughput calculations presented in the paper "Automated analysis of surface facets: the example of cesium telluride".

The file "Cs2Te_surfaces_workflows.aiida" contains the actual calculation data and the files with suffix "*.yaml" contain configuration files of the workflows.

Files

Files (3.5 GB)

Name Size
md5:cc598f128a1ecfda37842089761eae37
13.5 kB Download
md5:f1e64130056f2695b1e7e300a2bdc8fb
13.4 kB Download
md5:959cd5affca0cfcf47ab17f53b5794b8
13.4 kB Download
md5:343dfec50f3a8ddff24913ea4ca0190c
13.7 kB Download
md5:9dd0a17220925d0eeee45371e05d2bc1
12.7 kB Download
md5:d7358c54dfd627e337c28e5ef5752a9b
12.7 kB Download
md5:c6b5726003c70ba01d2686cc15940565
3.5 GB Download
md5:af3992c486e9a75d776224df47e7285b
12.7 kB Download

Additional details

Related works

Is supplement to
Journal article: 10.1038/s41524-024-01224-7 (DOI)