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Quasi-harmonic approximation
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Quasi-harmonic approximation : ウィキペディア英語版
Quasi-harmonic approximation
The quasi-harmonic approximation is a phonon-based model of solid-state physics used to describe volume-dependent thermal effects, such as the thermal expansion. It is based on the assumption that the harmonic approximation holds for every value of the lattice constant, which is to be viewed as an adjustable parameter.
== Overview ==
The quasi-harmonic approximation expands upon the harmonic phonon model of lattice dynamics. The harmonic phonon model states that all interatomic forces are purely harmonic, but such a model is inadequate to explain thermal expansion, as the equilibrium distance between atoms in such a model is independent of temperature.
Thus in the quasi-harmonic model, from a phonon point of view, phonon frequencies become volume-dependent in the quasi-harmonic approximation, such that for each volume, the harmonic approximation holds.

抄文引用元・出典: フリー百科事典『 ウィキペディア(Wikipedia)
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