Mo Fischer carbene complexes : a DFT study on the prediction of redox potentials

Adeniyi, Adebayo A.; Landman, Marile; Conradie, Jeanet

Mo Fischer carbene complexes : a DFT study on the prediction of redox potentials

dc.contributor.author	Adeniyi, Adebayo A.
dc.contributor.author	Landman, Marile
dc.contributor.author	Conradie, Jeanet
dc.date.accessioned	2022-09-08T04:31:34Z
dc.date.available	2022-09-08T04:31:34Z
dc.date.issued	2021-06
dc.description.abstract	Please read abstract in the article.	en_US
dc.description.department	Chemistry	en_US
dc.description.librarian	hj2022	en_US
dc.description.sponsorship	The University of the Free State; the National Research Foundation (NRF) in South Africa; the High-Performance Computing facility of the UFS, the Centre for High-Performance Computing (CHPC) of South Africa and the Norwegian Supercomputing Program.	en_US
dc.description.uri	https://iopscience.iop.org/journal/1945-7111	en_US
dc.identifier.citation	Adeniyi, A.A., Landman, M. & Conradie, J. 2021, 'Mo Fischer carbene complexes : a DFT study on the prediction of redox potentials', Journal of the Electrochemical Society, vol. 168, no. 6, art. 66523, pp. 1-17, doi : 10.1149/1945-7111/ac0a28.	en_US
dc.identifier.issn	0013-4651 (print)
dc.identifier.issn	1945-7111 (online)
dc.identifier.other	10.1149/1945-7111/ac0a28
dc.identifier.uri	https://repository.up.ac.za/handle/2263/87116
dc.language.iso	en	en_US
dc.publisher	Electrochemical Society	en_US
dc.rights	© 2021 The Electrochemical Society (“ECS”). Published on behalf of ECS by IOP Publishing Limited.	en_US
dc.subject	Carbene complexes	en_US
dc.subject	Oxidation potential	en_US
dc.subject	Reduction potential	en_US
dc.subject	Electron affinity	en_US
dc.subject	Ionization potential	en_US
dc.subject	Molecular electrostatic potential (MESP)	en_US
dc.title	Mo Fischer carbene complexes : a DFT study on the prediction of redox potentials	en_US
dc.type	Postprint Article	en_US