First-principles study of oxidation state and coordination of Cu-Dimers in Cu-SSZ-13 during methane-to-methanol reaction conditions
Journal article, 2019
Author
Unni Engedahl
Chalmers, Physics, Chemical Physics
Henrik Grönbeck
Chalmers, Physics, Chemical Physics
Anders Hellman
Chalmers, Physics, Chemical Physics
Journal of Physical Chemistry C
1932-7447 (ISSN) 1932-7455 (eISSN)
Vol. 123 43 26145-26150Subject Categories
Inorganic Chemistry
Other Physics Topics
Organic Chemistry
Areas of Advance
Nanoscience and Nanotechnology
Energy
Materials Science
Infrastructure
C3SE (Chalmers Centre for Computational Science and Engineering)
DOI
10.1021/acs.jpcc.9b07954