From: Ulf L. <ulf...@de...> - 2011-04-04 12:54:49
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On Fri, 2011-03-25 at 21:05 +0800, Jijun Xu wrote: > I downloaded the wavepacket software package from sourceforge. The > package is very excellent. I tried to study it and use it. But I > encountered a problem, how can i store the wave function every step > when I use qm_propa to calculate the time-dependent equation. I read > the manual, and tried to add > "psi.save.export=true;psi.save.dir='dir';psi.save.file='file.dat';psi.save.step=n" in the initialize.m, but the program cannot run normally. > would you mind give me suggestion? Thanks for your help! For the record: The culprit was a custom modification in the file psi_save.m. Ulf |