Physics:Born–von Karman boundary condition

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Short description: Periodic boundary condition in solid-state physics

The Born–von Karman boundary condition requires the wave function to be periodic on a certain Bravais lattice. Named after Max Born and Theodore von Kármán, this periodic boundary condition is often applied in solid-state physics to model an ideal crystal. Born and von Kármán published a series of articles in 1912 and 1913 that presented this model of the specific heat of solids based on the crystalline hypothesis and included this boundary condition.[1][2] Historically, the Born-von Karman boundary condition is, like the Debye model, an improvement upon the Einstein model of solids, the first quantum theory of specific heats.[3]

The condition can be stated as

ψ(𝐫+Ni𝐚i)=ψ(𝐫),

where i runs over the dimensions of the Bravais lattice, the ai are the primitive vectors of the lattice, and the Ni are integers (assuming the lattice has N cells where N=N1N2N3). This definition can be used to show that

ψ(𝐫+𝐓)=ψ(𝐫)

for any lattice translation vector T such that:

𝐓=iNi𝐚i.

Note, however, the Born–von Karman boundary conditions are useful when Ni are large (infinite).

The Born–von Karman boundary condition is important in solid-state physics for analyzing many features of crystals, such as diffraction and the band gap. Modeling the potential of a crystal as a periodic function with the Born–von Karman boundary condition and plugging in Schrödinger's equation results in a proof of Bloch's theorem, which is particularly important in understanding the band structure of crystals.

References

  1. von Kármán, Theodore; Born, Max (1912-04-15). "Über Schwingungen in Raumgittern" (in de). Physikalische Zeitschrift 13 (8): 297-309. https://hdl.handle.net/2027/mdp.39015023176806?urlappend=%3Bseq=365%3Bownerid=13510798901083269-399. 
  2. von Karman, Theodore; Born, Max (1913-01-01). "Zur Theorie der spezifischen Wärme" (in de). Physikalische Zeitschrift 14 (1): 15-19. https://hdl.handle.net/2027/mdp.39015021268936?urlappend=%3Bseq=49%3Bownerid=13510798901066996-55. 
  3. Jammer, Max (1966). The Conceptual Development of Quantum Mechanics. McGraw-Hill. pp. 58-9.