Vibrational Frequencies of Cerium-Oxide-Bound CO: A Challenge for Conventional DFT Methods

Journal: Physical Review Letters

Published: 2020-12-01

DOI: 10.1103/physrevlett.125.256101

Affiliations: 5

Authors: 8

Go to article
Institutions Share
Karlsruhe Institute of Technology (KIT), Germany 0.75
Institute of Catalysis and Petrochemistry (ICP), CSIC, Spain 0.19
Instituto de Física Rosario (IFIR CONICET-UNR), Argentina 0.06