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First-Principles-Based Multiscale Modelling of Nonoxidative Butane Dehydrogenation on Cr(2)O(3)(0001)

[Image: see text] Propane (C(3)H(8)) and butane (C(4)H(10)) are short straight-chain alkane molecules that are difficult to convert catalytically. Analogous to propane, butane can be dehydrogenated to butenes (also known as butylenes) or butadiene, which are used industrially as raw materials when s...

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Detalles Bibliográficos
Autores principales: Kopač, Drejc, Jurković, Damjan Lašič, Likozar, Blaž, Huš, Matej
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2020
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7754517/
https://www.ncbi.nlm.nih.gov/pubmed/33362945
http://dx.doi.org/10.1021/acscatal.0c03197