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Wave Functions and Character

Let us assume that we have solved the LMTO eigenvalue problem [Pg.91]

The Bloch sum of muffin-tin orbitals x (r) is most conveniently expressed by the one-centre expansion (6.15) valid inside the sphere at the origin [Pg.92]

By analogy we make the following definitions of the partial wave and its energy derivative, cf. (3.4,5), [Pg.92]

If we now combine (6.24-28) we may express the m-decomposed wave function in the form [Pg.92]

In the expression (6.29) for the m-decomposed wave function, the coefficients Aj and Bj k are completely specified by the band-structure calculation, [Pg.92]


See other pages where Wave Functions and Character is mentioned: [Pg.337]   


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