Optimized propagation schemes replasing calloc with malloc.

GHlacour / NISE_2017

This is the current development version of a quantum classical package for calculating coherent multidimensional spectra (as FTIR, SFG, 2DIR, 2DES, 2DSFG, and F-2DES).

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Optimized propagation schemes replasing calloc with malloc. #40

Closed GHlacour closed 11 months ago

GHlacour commented 11 months ago

Thanks Kim! Speedup of factor 4 seen for 2D spectra of LH2 tutorial. Minimal numerical differences observed from calloc version.