I have been trying to solve some organic (no heavy elements) crystal structures from x-ray powder data (not synchrotron) but with limited success. The first step, after indexing, has been structure factor extraction via FULLPROF and then trying to get a solution with SHELX97. Unfortunately, SHELX isn't really designed for use with powder data and I rarely get a good solution. Can anyone suggest some alternative method which might give better results?
- Re: Solving from powder data Bruce A. Weir
- Re: Solving from powder data Rayos_X
- Re: Solving from powder data L. Cranswick
