New PDFgui release

2009-04-17 Thread Simon Billinge
The Billinge group and diffraction sub-group of the DANSE project are pleased to announce the new code release DiffPy-1.0-r3067. The distribution includes PDFgui and PDFfit2 programs for real-space structure refinements to atomic pair distribution functions (PDFs). This release is our first non-be

Full exhaustive INDEX.EXE now multithreading enabled

2009-04-17 Thread Joerg Bergmann
Dear Rietvelders, the INDEX program as distributed on www.bgmn.de for free is now multithreading enabled. It does a full exhaustive search and takes care for the different statistical peak position errors/weightings as delivered by EFLECH, which was multithreading enabled too. See Z. Kristallogr.

RE: Crysfire

2009-04-17 Thread Martin
Dear Rhine In Crysfire, you have to use the import command (IM), not the load command. Make sure you have used the correct export command in Xfit first I.E "Peaks", "Two Theta, All Peak types" in the File Details section. Regards, Martin Martin Vickers Dept. of Chemistry, UCL, 20, Gordon Street