In situ observations of an active MoS2 model hydrodesulfurization catalyst.

Abstract:

:The hydrodesulfurization process is one of the cornerstones of the chemical industry, removing harmful sulfur from oil to produce clean hydrocarbons. The reaction is catalyzed by the edges of MoS2 nanoislands and is operated in hydrogen-oil mixtures at 5-160 bar and 260-380 °C. Until now, it has remained unclear how these harsh conditions affect the structure of the catalyst. Using a special-purpose high-pressure scanning tunneling microscope, we provide direct observations of an active MoS2 model catalyst under reaction conditions. We show that the active edge sites adapt their sulfur, hydrogen, and hydrocarbon coverages depending on the gas environment. By comparing these observations to density functional theory calculations, we propose that the dominant edge structure during the desulfurization of CH3SH contains a mixture of adsorbed sulfur and CH3SH.

journal_name

Nat Commun

journal_title

Nature communications

authors

Mom RV,Louwen JN,Frenken JWM,Groot IMN

doi

10.1038/s41467-019-10526-0

subject

Has Abstract

pub_date

2019-06-11 00:00:00

pages

2546

issue

1

issn

2041-1723

pii

10.1038/s41467-019-10526-0

journal_volume

10

pub_type

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