Electron-Stimulated Emission of Na Atoms from NaCl Nanocube Corners

Physics – Condensed Matter – Materials Science

Scientific paper

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7 pages, 2 figures, 1 table; to appear on Surf. Sci

Scientific paper

10.1016/j.susc.2006.02.074

We performed first principles density functional calculations and simulations
of magic-size neutral NaCl nanocubes, and computed the the extraction of a Na
neutral corner atom after donating an electron. The atomic structure of the
resulting Na corner vacancy is presented.

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