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Phys. Rev. Lett. 70, 3103–3106 (1993)

Quantum mechanics of electrons in crystals with graded composition

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Michael R. Geller and Walter Kohn
Department of Physics, University of California(enSanta Barbara, Santa Barbara, California 93106

Received 25 January 1993; published in the issue dated 17 May 1993

We construct the effective Hamiltonian describing the motion of electrons in compositionally graded crystals which is valid throughout a given energy band and part way into the gaps. Near the edges of a simple or degenerate band this effective Hamiltonian reduces to an effective mass Hamiltonian with position dependent effective mass. Next, we examine more general states—not restricted to the vicinity of a band edge—in crystals with composition and applied potential variation in one direction. We obtain a WKB-type solution for the envelope functions, as well as the appropriate turning point connection rules.

© 1993 The American Physical Society

URL:
http://link.aps.org/doi/10.1103/PhysRevLett.70.3103
DOI:
10.1103/PhysRevLett.70.3103
PACS:
73.20.Dx, 71.10.+x, 71.50.+t, 78.66.-w