[gmx-users] Fourier transformation of dipole autocorrelation function in matlab

Nilesh Dhumal ndhumal at andrew.cmu.edu
Fri Jan 28 18:22:01 CET 2011


Hello,

I am trying to calculate the vibrational spectra  Fourier transforming the
dipolemoment autocorrelation function.

Does any one know how to calculate the Fourier transformation of dipole
autocorrelation in matlab.
function.
Thanks
Nilesh






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