DOI: 10.1063/10.0029686 ISSN: 0360-0335

Valence electron distribution and “atomic size” in crystals

E. V. Zarochentsev, E. Ya. Fain

Valence electron distributions are analyzed for crystals of various types. It is found that for a given element the distance from the center of an atom to the maximum (minimum) along the “bond” the valence electron density remains roughly the same in crystals of different structures. A correlation is shown to exist between the distance mentioned above and the radius of the external valence orbital of the free atom.

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