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[sdpd] New version of Overlap program for Processing Extracted Intensities.
- To: sdpd... @egroups.com (SDPD Structure Solution Mailing List)
- Subject: [sdpd] New version of Overlap program for Processing Extracted Intensities.
- From: L.M.D.Cranswick... @dl.ac.uk (L. Cranswick)
- Date: Sun, 18 Jul 1999 22:07:11 +0100 (BST)
- Delivered-to: listsaver-egroups-sdpd... @egroups.com
- Mailing-list: contact sdpd-owner... @egroups.com
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There is a new version of Armel Le Bail's Overlap available
on the web that can now handle SirPow and EXPO HKL data
(as well as fullprof and manually extracted intensity HKL data).
http://fluo.univ-lemans.fr:8001/ftp/overlap.zip
http://www.cristal.org/ftp/overlap.zip
http://www.ccp14.ac.uk/ccp/web-mirrors/armel/ftp/overlap.zip
ftp://ftp.minerals.csiro.au/pub/xtallography/ccp14/ccp/web-mirrors/armel/ftp/overlap.zip
For those unfamiliar with the Overlap program: Overlap
takes in a list of powder extracted intensities and
prepares it for possible structure solution by single Crystal
structure solution software.
This includes being able to output Fo's and FoSQ's,
setting the ESDs to more friendly values and elliminating
reflections that are too overlapping.
=======
For an example of applying single crystal software to
try and solve structures using powder extracted intensities,
refer:
Using WinGX with Powder Diffraction Extracted Intensities
for Structure Solution and Space Group Assignment
http://www.ccp14.ac.uk/tutorial/wingx/powder/
Lachlan.
--
Lachlan M. D. Cranswick
Collaborative Computational Project No 14 (CCP14)
for Single Crystal and Powder Diffraction
Daresbury Laboratory, Warrington, WA4 4AD U.K
Tel: +44-1925-603703 Fax: +44-1925-603124
E-mail: l.cranswick... @dl.ac.uk Ext: 3703 Room C14
NEW CCP14 Web Domain (Under heavy construction):
http://www.ccp14.ac.uk