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Title:

Active Site Representation in First-Principles Microkinetic Models: Data-Enhanced Computational Screening for Improved Methanation Catalysts

Document type:
Zeitschriftenaufsatz
Author(s):
Deimel, Martin; Reuter, Karsten; Andersen, Mie
Journal title:
ACS Catalysis
Year:
2020
Journal volume:
10
Journal issue:
22
Pages contribution:
13729-13736
Fulltext / DOI:
doi:10.1021/acscatal.0c04045
Publisher:
American Chemical Society (ACS)
E-ISSN:
2155-54352155-5435
Date of publication:
10.11.2020
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