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Definition of the Model and Dynamical Matrix

2 The Rigid-Ion Model for Ionic Crystals 4.2.1 Definition of the Model and Dynamical Matrix [Pg.106]

In the rigid-ion model, an ion of type k carries a point charge z e, where e is the magnitude of the electronic charge thus, the ions are not polarizable. The interaction energy of two ions i = ( ) and k = (, ) separated by a distance R. is [Pg.106]

Instead of (4.19), the repulsive energy could also be approximated by an expression of the form B/R as has been used for the solid inert gases (Sect.4.1). In any case, is a short-range energy which in a first approximation may be extended to nearest-neighbour ions only. On the other hand, cp represents the long-range Coulomb forces and it is this term which will complicate the lattice dynamical problem considerably. [Pg.107]

Since we are dealing with central forces, the force constants can be obtained directly from Appendix J. According to (4.18) and (J.4 and 7), the total force constants are [Pg.107]

Similarly, we obtain for the force constants of the Coulomb forces for i + k [Pg.108]




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