[Blends-commit] [SCM] pan branch, master, updated. bac23fab98ff255914893424b897afe7fb16489f

Picca Frédéric-Emmanuel picca at debian.org
Wed Nov 20 21:52:39 UTC 2013


The following commit has been merged in the master branch:
commit bac23fab98ff255914893424b897afe7fb16489f
Author: Picca Frédéric-Emmanuel <picca at debian.org>
Date:   Wed Nov 20 22:52:27 2013 +0100

    add the pyGSAS package

diff --git a/tasks/powder b/tasks/powder
index 152a684..3ea1425 100644
--- a/tasks/powder
+++ b/tasks/powder
@@ -29,3 +29,53 @@ Homepage: http://sourceforge.net/projects/xrdua/
 License: GPL3+
 Pkg-Description: X-ray Powder Diffraction
 Comment: test if it works with gdl
+
+Suggests: pyGSAS
+Homepage: https://subversion.xor.aps.anl.gov/trac/pyGSAS
+License: DSFG
+ Copyright 2010, UChicago Argonne, LLC, Operator of Argonne National
+ Laboratory All rights reserved.
+ .
+ GSAS-II may be used by anyone on a royalty-free basis. Use and
+ redistribution, with or without modification, are permitted provided
+ that the following conditions are met:
+ .
+ * Redistributions of source code must retain the above copyright
+   notice, this list of conditions and the following disclaimer.
+ * Software changes, modifications, or derivative works should be noted
+   with comments and the author and organization's name.
+ * Distribution of changed, modified or derivative works based on
+   GSAS-II grants the GSAS-II copyright holder unrestricted permission
+   to include any, or all, new and changed code in future GSAS-II
+   releases.
+ * Redistributions that include binary forms must include all relevant
+   source code and reproduce the above copyright notice, this list of
+   conditions and the following disclaimers in the documentation and/or
+   other materials provided with the distribution.
+ * Neither the names of UChicago Argonne, LLC or the Department of
+   Energy nor the names of its contributors may be used to endorse or
+   promote products derived from this software without specific prior
+   written permission.
+ * The software and the end-user documentation included with the
+   redistribution, if any, must include the following acknowledgment:
+   "This product includes software produced by UChicago Argonne, LLC
+   under Contract No. DE-AC02-06CH11357 with the Department of Energy."
+Pkg-Description: crystallography multi purpose python library
+ GSAS-II is an open source Python project that addresses all types of
+ crystallographic studies, from simple materials through
+ macromolecules, using both powder and single-crystal diffraction and
+ with both x-ray and neutron probes. Measurements can be constant
+ wavelength (or in the future, neutron TOF.) At present, code is being
+ developed for all the various steps in diffraction analysis, such as
+ data reduction, peak analysis, indexing, structure solution and
+ structure refinement.
+ .
+ At present GSAS-II can be used for processing of area detector data,
+ peak fitting, auto-indexing, structure solution, Pawley and Rietveld
+ fitting. Many of the nice features of GSAS are present and some
+ things work much better than in GSAS, but other features are yet to
+ come. At this point only x-rays and constant wavelength neutrons are
+ implemented (no TOF). The GUI is self-documenting with help pages for
+ every GUI page. The code is changing on a regular basis, so expect
+ things to break from time to time and you should 'Update' frequently
+ to stay abrest of new features as they are added.
\ No newline at end of file

-- 
Debian Pan



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