2.5 a) Calculate the five lowest "free electron" bands along the 4-axis in the Brillouin zone for the simple cubic lattice (analogous to Fig. 2.35). Calculate the associated eigenfunctions. b) For bands which are degenerate along the 4-axis (or at I or at X), construct linear combinations of the wave functions in such a way that the new func-

Physical Chemistry
2nd Edition
ISBN:9781133958437
Author:Ball, David W. (david Warren), BAER, Tomas
Publisher:Ball, David W. (david Warren), BAER, Tomas
Chapter13: Introduction To Symmetry In Quantum Mechanics
Section: Chapter Questions
Problem 13.21E
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2.5
a) Calculate the five lowest "free electron" bands along the A-axis in the
Brillouin zone for the simple cubic lattice (analogous to Fig. 2.35). Calculate
the associated eigenfunctions.
b) For bands which are degenerate along the 4-axis (or at r or at X), construct
linear combinations of the wave functions in such a way that the new func-
464
Problems to Chapters 1-9
tions are either invariant to the group operations, or reduce to sets of
functions which transform into one another. Such sets form the basis func-
tions for the irreducible representations of the group of the k-vector.
Transcribed Image Text:2.5 a) Calculate the five lowest "free electron" bands along the A-axis in the Brillouin zone for the simple cubic lattice (analogous to Fig. 2.35). Calculate the associated eigenfunctions. b) For bands which are degenerate along the 4-axis (or at r or at X), construct linear combinations of the wave functions in such a way that the new func- 464 Problems to Chapters 1-9 tions are either invariant to the group operations, or reduce to sets of functions which transform into one another. Such sets form the basis func- tions for the irreducible representations of the group of the k-vector.
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