Lorentzian fitting tool for phonon spectral energy density and general use

By Tianli Feng1, Xiulin Ruan1

1. Purdue University

Fit a general data set (or specially the phonon spectral energy density) as a Lorentzian function to obtain the peak position (or phonon frequency) and full width at half maximum (or relaxation time).

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Version 1.2.1 - published on 29 Aug 2017

doi:10.4231/D3057CV3Q cite this

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Simulation Users

52

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Wall Clock Time 12.76 minutes 18.66 days
CPU time 25.2 seconds 14.74 hours
Interaction Time 8.36 minutes 12.23 days