Effect of confinement on the structure and energetics of Zundel cation present inside the hydrophobic carbon nanotubes: an ab initio study

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Date

2014

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Keywords

Carbon nanotubes, Zundel cation, Proton transfer, Confinement, Density functional theory

Source

Theoretical Chemistry Accounts, 2014. Vol. 133 (12): Article no. 1576

URI

http://hdl.handle.net/123456789/11610

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2014