christophe-heinrich
Hi all,
I am a fairly new Topas user and was wondering if it is possible to plot the spherical harmonics after using the PO_Spherical_Harmonics(sh, n) command?
johnsoevans
You can in topas v5. In v4 you can output the value of sh for eacph hhkl ref and plot with another package
fgispert
Dear John,
I have obtained the sh value for each hkl. Now the question is: It is possible to get the error of each sh in the same output?
The code written is:
phase_out I98_HT.txt append load out_record out_fmt out_eqn
{
"%4.0f" = H;
"%4.0f" = K;
"%4.0f" = L;
" %4.5f" = Th;
" %9g\n" = sh;
}
rowlesmr
Hi John
what package do you use to plot the harmonics?
I'm on 4.2 atm, and am taking a brief foray into SH for some PO corrections.
Matthew