Time-dependent density functional theory calculations of electronic friction in non-homogeneous media - Archive ouverte HAL
Article Dans Une Revue Physical Chemistry Chemical Physics Année : 2022

Time-dependent density functional theory calculations of electronic friction in non-homogeneous media

Résumé

We assess the reliability of the local density friction approximation and show that, despite the strong approximations involved, it is able to provide a good estimate of the friction force suffered by an atomic particle at a metal surface.
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Dates et versions

hal-03797960 , version 1 (03-01-2023)

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Natalia Koval, Daniel Sánchez-Portal, Andrey Borissov, Ricardo Díez Muiño. Time-dependent density functional theory calculations of electronic friction in non-homogeneous media. Physical Chemistry Chemical Physics, 2022, 24 (34), pp.20239-20248. ⟨10.1039/D2CP01972H⟩. ⟨hal-03797960⟩
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