Effect of water on the oxidation of CO by a Criegee intermediate

Phys. Chem. Chem. Phys., 2020, Advance Article DOI: 10.1039/D0CP02682D, PaperAmit Kumar, Subhasish Mallick, Pradeep Kumar The present work employs the CCSD(T)/CBS//M06-2X/aug-cc-pVTZ level of theory to investigate the effect of a water monomer and dimer on the oxidation of carbon-monoxide by a Criegee intermediate (CH2OO). To cite this article before page numbers are assigned, use the DOI form of citation above. The content of this RSS Feed (c) The Royal Society of Chemistry
Source: RSC - Phys. Chem. Chem. Phys. latest articles - Category: Chemistry Authors: Source Type: research