Atomistic and Molecular Effects in Electric Double Layers at High Surface Charges

The Poisson-Boltzmann theory for electrolytes near a charged surface is known to be invalid due to unaccounted physics associated with high ion concentration regimes. To investigate this regime, fluids density functional theory (f-DFT) and molecular dynamics (MD) simulations were used to determine e...

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Veröffentlicht in:Langmuir : the ACS journal of surfaces and colloids. - 1992. - 31(2015), 27 vom: 14. Juli, Seite 7496-502
1. Verfasser: Lee, Jonathan W (VerfasserIn)
Weitere Verfasser: Mani, Ali, Templeton, Jeremy A
Format: Online-Aufsatz
Sprache:English
Veröffentlicht: 2015
Zugriff auf das übergeordnete Werk:Langmuir : the ACS journal of surfaces and colloids
Schlagworte:Journal Article