Automated analysis of surface facets: the example of cesium telluride

Abstract High-throughput screening combined with ab initio calculations is a powerful tool to explore technologically relevant materials characterized by complex configurational spaces. Despite the impressive developments achieved in this field in the last few years, most studies still focus on bulk...

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Bibliographic Details
Main Authors: Holger-Dietrich Saßnick, Caterina Cocchi
Format: Article
Language:English
Published: Nature Portfolio 2024-02-01
Series:npj Computational Materials
Online Access:https://doi.org/10.1038/s41524-024-01224-7