acf autocorrelation-function autocorrelation-integral characteristic-timescales data-analysis exponential-correlation-time integrated-correlation-time lgpl molecular-dynamics open-source post-processing power-spectral-distribution psd python-package scientific-computing stacie time-correlation transport-properties uncertainty-quantification

acf autocorrelation-function autocorrelation-integral dataset exponential-correlation-time integrated-correlation-time power-spectral-distribution psd python stacie stepup systematic-validation typst worfklow