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The energetics of carbonated PuO2 surfaces affects nanoparticle morphology: a DFT+U study.
Moxon, Samuel; Symington, Adam R; Tse, Joshua S; Dawson, James; Flitcroft, Joseph M; Parker, Stephen C; Cooke, David J; Harker, Robert M; Molinari, Marco.
Afiliação
  • Moxon S; Department of Chemical Sciences, University of Huddersfield, Queensgate, Huddersfield, HD1 3DH, UK. m.molinari@hud.ac.uk samuel.moxon@hud.ac.uk.
  • Symington AR; Department of Chemistry, University of Bath, Claverton Down, Bath, BA2 7AY, UK.
  • Tse JS; Department of Chemical Sciences, University of Huddersfield, Queensgate, Huddersfield, HD1 3DH, UK. m.molinari@hud.ac.uk samuel.moxon@hud.ac.uk.
  • Dawson J; Department of Chemical Sciences, University of Huddersfield, Queensgate, Huddersfield, HD1 3DH, UK. m.molinari@hud.ac.uk samuel.moxon@hud.ac.uk.
  • Flitcroft JM; Department of Chemical Sciences, University of Huddersfield, Queensgate, Huddersfield, HD1 3DH, UK. m.molinari@hud.ac.uk samuel.moxon@hud.ac.uk.
  • Parker SC; Department of Chemistry, University of Bath, Claverton Down, Bath, BA2 7AY, UK.
  • Cooke DJ; Department of Chemical Sciences, University of Huddersfield, Queensgate, Huddersfield, HD1 3DH, UK. m.molinari@hud.ac.uk samuel.moxon@hud.ac.uk.
  • Harker RM; AWE Aldermaston, Reading, RG7 4PR, UK.
  • Molinari M; Department of Chemical Sciences, University of Huddersfield, Queensgate, Huddersfield, HD1 3DH, UK. m.molinari@hud.ac.uk samuel.moxon@hud.ac.uk.
Phys Chem Chem Phys ; 22(15): 7728-7737, 2020 Apr 15.
Article em En | MEDLINE | ID: mdl-32191781
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Texto completo: 1 Base de dados: MEDLINE Tipo de estudo: Prognostic_studies Idioma: En Ano de publicação: 2020 Tipo de documento: Article
Texto completo
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PubMed Links
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Texto completo: 1 Base de dados: MEDLINE Tipo de estudo: Prognostic_studies Idioma: En Ano de publicação: 2020 Tipo de documento: Article