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Hydrogen Bonds in Lead Halide Perovskites: Insights from Ab Initio Molecular Dynamics

[Image: see text] Hydrogen bonds (HBs) play an important role in the rotational dynamics of organic cations in hybrid organic/inorganic halide perovskites, thus affecting the structural and electronic properties of the perovskites. However, the properties and even the existence of HBs in these perov...

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Detalles Bibliográficos
Autores principales:	Garrote-Márquez, Alejandro, Lodeiro, Lucas, Suresh, Rahul, Cruz Hernández, Norge, Grau-Crespo, Ricardo, Menéndez-Proupin, Eduardo
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	American Chemical Society 2023
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10440809/ https://www.ncbi.nlm.nih.gov/pubmed/37609385 http://dx.doi.org/10.1021/acs.jpcc.3c02376

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