A rather belated announcement. Since August 2002, the Dirdif Patterson and Difference Direct Methods based Structure Solution Software by Paul Beurskens et al...
The conference "Structure Solution from Powder Diffraction Data" (SSPD'03) is to be held at the Congress Center Academia, Stara Lesna, Slovakia, September...
Dear Participants to the Structure Determination by Powder Diffractometry Round Robin 2, This is the last reminder for the Step 1 (indexing). We are very close...
Dear Powder Diffraction Users, The Indexing step 1 of the SDPDRR-2 (Structure Determination by Powder Diffractometry Round Robin -2) is closed. Despite of more...
Dear All: I got an error message while trying to refine by Fullprof says: No reflections found---Check your input data. Could you please tell which part of...
... Min and max angles, cell parameters, are they correct and are they at the right place (extra line or lacking line in the .pcr may lead to cell parameters...
"I got an error message while trying to refine by Fullprof says: No reflections found---Check your input data. Could you please tell which part of input data ...
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Yokochi, Alexandre
alex.yokochi@...
Oct 15, 2002 4:40 pm
Hi, OK, yet an additional commentary to htose by Armel and Guilhem, to put things in perspective. What this error message really means (as I deduced from...
885
Jinhang Wang
w_jinhang@...
Oct 18, 2002 3:40 am
DEAR ALL, There is a questions on GSAS, when doing the exercise of ZrO2 in the zip file attached in GSAS,first I extracted Fos with one H atom and get...
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Jonathan WRIGHT
wright@...
Oct 18, 2002 7:47 am
... You calculated a Patterson map and found a large peak at 0,0,0 and then assumed this was an atom? Patterson maps always have big peaks at the origin, so...
Hi, McMaille for indexing powder diffraction patterns needs now two times less Monte Carlo (MC) events for obtaining the same result. This is equivalent to...
888
msb46@...
Oct 18, 2002 3:36 pm
Hello, I'm just starting to do the sdpd problem sets but unfortunately I can't work out how to convert the data files to Scintag .raw files. Does anyone know...
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Peter Zavalij
zavalij@...
Oct 18, 2002 3:47 pm
To my best knowledge there is no way of doing that. Any way this is no phase identification... Dr. Peter Y. Zavalij University Crystallographer Institute for...
... In theory, Nita Dragoe's Powder v4 for windows will do this. But I am not sure if it is referring to the .raw file or the old Scintag ARD ascii files. ...
Dear Armel, Guilhem, Yokochi and All: Thank you very much for your expert instructions ! However, i still cann't find what's wrong: attached pls find my files,...
Hi, it would be probably useful if you simulate first your "*.pcr" file. For that just change the first parameter Jobtype (0 becomes 2). and run the program. ...
893
kmiller@...
Oct 22, 2002 9:43 am
I will be out of the office starting 21/10/2002 and will not return until 25/10/2002. I am currently out of the office and will respond to your message when I...
894
Adam Guzik
aguzik@...
Oct 22, 2002 10:09 am
send your data and .pcr files, pls. Adam ... From: "Xia Changtai" <Xia-CT@...> To: <sdpd@yahoogroups.com> Sent: Tuesday, October 22, 2002 9:50...
... The SDPD Mailing list refuses attachments, in order to avoid viruses, or too big files, spamming, etc. Please send the data privately or deposit them at a...
The McMaille Monto Carlo whole powder profile indexing program by Armel Le Bail has been significantly updated. ... McMaille Homepage and download at: ...
897
Helena Braga
helena.braga@...
Oct 30, 2002 4:38 pm
Hello, I'm Helena Braga. Althougt it's the first time I'm putting questions in this mailing list, I've been paying attention to all the questions and news. I ...
898
Natale Perchiazzi
natale@...
Oct 30, 2002 5:01 pm
Helena SPGEN is one of these, I use it and it works nicely. You can find it on the Sincris or CCCP14 sites Best whishes Prof. Natale Perchiazzi Dipartimento di...
Dear all, I am trying to index a pattern with Crysfire, and it seems possible that the cell is triclinic. When I wanted to confirm the cell proposed by Ito and...
903
Robin Shirley
R.Shirley@...
Nov 1, 2002 6:12 pm
Dear Cora Your request is obviously something that, as Crysfire author, I should be fielding. Since most users are not as brave as you, Crysfire's support of...
Dear all. I am working in the study of ErSi2 thin films grown onto Si(111)substrate. I would like to know if it is possible to fit the X-Ray diffraction of...
905
kmiller@...
Nov 5, 2002 1:08 pm
I will be out of the office starting 04/11/2002 and will not return until 08/11/2002. I am currently out of the office and will respond to your message when I...
Dear Powder Diffraction Users, The SDPDRR-2 step 2 (structure solution and refinement) deadline is coming soon : 17th November 2002. Ten days for solving 3...
