activity
20062025
most citedGradient-dependent density functionals of the PBE type for atoms, molecules and solids

95 citations · 165 across the 10 of their papers we have counts for

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Showing 2014Show all

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physics.chem-ph2014★ 2 cited

Local order of liquid water at the electrochemical interface

Luana S. Pedroza, Adrien Poissier, M. -V. Fernández-Serra

We study the structure and dynamics of liquid water in contact with Pd and Au (111) surfaces using \emph{ab initio} molecular dynamics simulations with and without van der Waals in…