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The Limited Predictive Power of the Pauling Rules

The Pauling rules have been used for decades to rationalise the crystal structures of ionic compounds. Despite their importance, there has been no statistical assessment of the performances of these five empirical rules so far. Here, we rigorously and automatically test all five Pauling rules for a...

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Detalles Bibliográficos
Autores principales: George, Janine, Waroquiers, David, Di Stefano, Davide, Petretto, Guido, Rignanese, Gian‐Marco, Hautier, Geoffroy
Formato: Online Artículo Texto
Lenguaje:English
Publicado: John Wiley and Sons Inc. 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7217010/
https://www.ncbi.nlm.nih.gov/pubmed/32065708
http://dx.doi.org/10.1002/anie.202000829