Methanol Synthesis Over PdIn, In2O3, and CuZn From First-Principles Microkinetics: Similarities and Differences
Journal article, 2022
Author
Minttu Maria Kauppinen
Chalmers, Physics, Chemical Physics
Alvaro Posada Borbon
Chalmers, Physics, Chemical Physics
Henrik Grönbeck
Chalmers, Physics, Chemical Physics
Journal of Physical Chemistry C
1932-7447 (ISSN) 1932-7455 (eISSN)
Vol. 126 36 15235-15246Adaptive multiscale modeling in heterogeneous catalysis
Swedish Research Council (VR) (2020-05191), 2021-01-01 -- 2024-12-31.
Subject Categories
Inorganic Chemistry
Chemical Process Engineering
Other Chemical Engineering
Other Physics Topics
Organic Chemistry
DOI
10.1021/acs.jpcc.2c05715