TY - GEN A1 - George, Janine A1 - Naik, Aakash Ashok A1 - Jackson, A. J. A1 - Baird, S. T1 - Scripts to reproduce "Automated bonding analysis with crystal orbital Hamilton populations" N2 - This repo allows to recreate our publication: https://doi.org/10.1002/cplu.202200123 In contrast to 0.2.2, we fixed an issue with absolute path. PB - Zenodo CY - Geneva KW - Automation KW - High-throughput computations KW - Bonding analysis PY - 2022 UR - https://opus4.kobv.de/opus4-bam/frontdoor/index/index/docId/55177 AN - OPUS4-55177 UR - https://github.com/JaGeo/LobsterAutomation UR - https://doi.org/10.5281/zenodo.6421928 UR - https://doi.org/10.5281/zenodo.6595062 UR - https://doi.org/10.5281/zenodo.6599556 UR - https://doi.org/10.5281/zenodo.6674670 UR - https://doi.org/10.5281/zenodo.6704163 AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany