Rietan2000 help needed

2009-03-03 Thread Ralf Theissmann
Dear Lister, if any Rietan2000 user could contact me off-list please, I am having trouble to get the program to work… Best Regards, Ralf - Dr. Ralf Theissmann Universität Duisburg-Essen Fakultät für Ingenieurwissenschaften

cRs

2009-03-03 Thread Olga Smirnova
Dear All, How is life with conventional R factors when you always have to divide by zero background? Let's have time. Considering a part of the profile without peaks one gets 100% cR. I did not give the agreement factor; I would say those cR with all non-excluded points is incorrect, but cR

RE: cRs

2009-03-03 Thread Brian O'Connor
Background removal is verbotten! Brian O'Connor From: Olga Smirnova [mailto:olga.smirn...@hw7.ecs.kyoto-u.ac.jp] Sent: Wed 4/03/2009 2:14 PM To: rietveld_l@ill.fr Subject: cRs Dear All, How is life with conventional R factors when you always have to divide by

RE: cRs

2009-03-03 Thread Matthew.Rowles
It's German... verboten == forbidden. You should never delete the background from a diffraction pattern prior to (Rietveld) analysis. It changes peak positions and shapes and generally is bad. Cheers Matthew Matthew Rowles CSIRO Minerals Box 312 Clayton South, Victoria

RE: cRs

2009-03-03 Thread Maxim V. Lobanov
As far as I understand, the major issue is that BG subtraction changes the error statistics (accordingly, weights applied in calculating function to minimize...). It is also somewhat arbitrary how you choose the BG line - so, you can easily subtract part of Bragg contribution from base of peak