23 May
2013
23 May
'13
11:15 p.m.
Dear all, Can an experienced user kindly explain how to obtain the phase shift correction to the radial distance corresponding to FFT(chi(k)). From my chi(k) computation, I have several feff*.dat files (feff0001.dat, feff0002.dat,...............,feff00128.dat) because I have 128 paths. How do I use this information and IFEFFIT to compute the shifted spectrum? Thank you.