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- W1517905087 abstract "We present a general harmonic theory for the temperature dependence of phonon-renormalized properties of solids. Firstly, we formulate a perturbation theory in phonon-phonon interactions to calculate the phonon renormalization of physical quantities. Secondly, we propose two new schemes for extrapolating phonon zero-point corrections from temperature dependent data that improve the accuracy by an order of magnitude compared to previous approaches. Finally, we consider the low-temperature limit of the class of observables that includes the electronic band gap, obtaining a $T^4$ dependence in three dimensions, $T^2$ in two dimensions, and $T^{3/2}$ in one dimension." @default.
- W1517905087 created "2016-06-24" @default.
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- W1517905087 date "2014-11-12" @default.
- W1517905087 modified "2023-10-16" @default.
- W1517905087 title "Extracting semiconductor band gap zero-point corrections from experimental data" @default.
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- W1517905087 doi "https://doi.org/10.1103/physrevb.90.184302" @default.
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