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Potassium atom, electron localization function

Fig. 2.29 The electron localization function of the potassium atom, adapted from Ref. [106]. Fig. 2.29 The electron localization function of the potassium atom, adapted from Ref. [106].
It is also possible to prepare crystalline electrides in which a trapped electron acts in effect as the anion. The bulk of the excess electron density in electrides resides in the X-ray empty cavities and in the interconnecting channels. Structures of electri-dides [Li(2,l, 1-crypt)]+-e [K(2,2,2-crypt)]+-e, [Rb(2,2,2-crypt)]+-e, [Cs(18-crown-6)2]+ e , [Cs(15-crown-5)2]+-e and mixed-sandwich electride [Cs(18-crown-6)(15-crown-5) e ]6 l8-crown-6 are known. Silica-zeolites with pore diameters of 7 A have been used to prepare silica-based electrides. The potassium species contains weakly bound electron pairs which appear to be delocalized, whereas the cesium species have optical and magnetic properties indicative of electron localization in cavities with litde interaction between the electrons or between them and the cation. The structural model of the stable cesium electride synthesized by intercalating cesium in zeolite ITQ-4 has been confirmed by the atomic pair distribution function (PDF) analysis. The synthetic methods, structures, spectroscopic properties, and magnetic behavior of some electrides have been reviewed. Theoretical study on structural and electronic properties of inorganic electrides has also been addressed recently. ... [Pg.63]


See other pages where Potassium atom, electron localization function is mentioned: [Pg.104]    [Pg.262]    [Pg.247]    [Pg.437]    [Pg.477]    [Pg.232]    [Pg.144]    [Pg.150]   
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Atomic functions

Atomic localization

Electron functionalization

Electron localization

Electron localization function

Electron localization function , local

Function localization

Local functionals

Localized functions

Localizing electrons

Potassium atom

Potassium electrons

Potassium functions

Potassium localization

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