Theory of the electrostatic surface potential and intrinsic dipole moments at the mixed ionic electronic conductor (MIEC)-gas interface

Williams, Nicholas J.; Seymour, Ieuan D.; Leah, Robert T.; Mukerjee, Subhasish; Selby, Mark; Skinner, Stephen J.

Theory of the electrostatic surface potential and intrinsic dipole moments at the mixed ionic electronic conductor (MIEC)-gas interface

dc.contributor.author	Williams, Nicholas J.
dc.contributor.author	Seymour, Ieuan D.
dc.contributor.author	Leah, Robert T.
dc.contributor.author	Mukerjee, Subhasish
dc.contributor.author	Selby, Mark
dc.contributor.author	Skinner, Stephen J.
dc.contributor.institution	University of Aberdeen.Chemistry	en
dc.date.accessioned	2023-07-04T17:00:01Z
dc.date.available	2023-07-04T17:00:01Z
dc.date.issued	2021-07-21
dc.description	Funding Information: This work was supported by Ceres Power Ltd. All first principle calculations were performed using the Imperial College Research Computing Service (DOI: 10.14469/hpc/2232). We are also grateful for the discussion with Dr Alex Shard from the National Physical Laboratory, Teddington, UK, on analysingoperandoXPS data. We also acknowledge the support of the EPSRC through the award of a platform grant (EP/R002010/1) and through support for the Centre for Doctoral Training in the Advanced Characterisation of Materials (EP/L015277/1). Funding Information: This work was supported by Ceres Power Ltd. All first principle calculations were performed using the Imperial College Research Computing Service (DOI: 10.14469/hpc/2232). We are also grateful for the discussion with Dr Alex Shard from the National Physical Laboratory, Teddington, UK, on analysing operando XPS data. We also acknowledge the support of the EPSRC through the award of a platform grant (EP/R002010/1) Publisher Copyright: © the Owner Societies 2021.	en
dc.description.status	Peer reviewed	en
dc.format.extent	11
dc.format.extent	4178001
dc.identifier	242423008
dc.identifier	89c775de-fe5a-4b0f-be73-f797b5a3e342
dc.identifier	85110461907
dc.identifier	33988196
dc.identifier.citation	Williams, N J, Seymour, I D, Leah, R T, Mukerjee, S, Selby, M & Skinner, S J 2021, 'Theory of the electrostatic surface potential and intrinsic dipole moments at the mixed ionic electronic conductor (MIEC)-gas interface', Physical Chemistry Chemical Physics, vol. 23, no. 27, pp. 14569-14579. https://doi.org/10.1039/d1cp01639c	en
dc.identifier.doi	10.1039/d1cp01639c
dc.identifier.iss	27	en
dc.identifier.issn	1463-9076
dc.identifier.other	ORCID: /0000-0002-9550-9971/work/168097927
dc.identifier.uri	https://hdl.handle.net/2164/21111
dc.identifier.url	http://www.scopus.com/inward/record.url?scp=85110461907&partnerID=8YFLogxK	en
dc.identifier.vol	23	en
dc.language.iso	eng
dc.relation.ispartof	Physical Chemistry Chemical Physics	en
dc.subject	QC Physics	en
dc.subject	QD Chemistry	en
dc.subject	General Physics and Astronomy	en
dc.subject	Physical and Theoretical Chemistry	en
dc.subject.lcc	QC	en
dc.subject.lcc	QD	en
dc.title	Theory of the electrostatic surface potential and intrinsic dipole moments at the mixed ionic electronic conductor (MIEC)-gas interface	en
dc.type	Journal article	en

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