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Local Bonding Influence on the Band Edge and Band Gap Formation in Quaternary Chalcopyrites

Quaternary chalcopyrites have shown to exhibit tunable band gaps with changing anion composition. Inspired by these observations, the underlying structural and electronic considerations are investigated using a combination of experimentally obtained structural data, molecular orbital considerations,...

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Detalles Bibliográficos
Autores principales:	Miglio, Anna, Heinrich, Christophe P., Tremel, Wolfgang, Hautier, Geoffroy, Zeier, Wolfgang G.
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	John Wiley and Sons Inc. 2017
Materias:	Full Papers
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5604395/ https://www.ncbi.nlm.nih.gov/pubmed/28932668 http://dx.doi.org/10.1002/advs.201700080

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