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Old 05-20-2012, 06:35 PM
Michael Banck
 
Default Bug#674135: ITP: spglib -- Crystal Symmetry Library

Package: wnpp
Severity: wishlist
Owner: DebiChem Project <debichem-devel@lists.alioth.debian.org>


* Package name : spglib
Version : 1.0.8
Upstream Author : Atsushi Togo <atz.togo@gmail.com>
* URL : http://spglib.sourceforge.net
* License : BSDish
Programming Lang: C
Description : Crystal Symmetry Library

Spglib is a library to find and handle crystal symmetries.
.
Features include:
.
* Identify space-group type
* Find symmetry operations
* Find a primitive cell
* Search irreducible k-points
* Refine crystal structure
* Wyckoff position assignment




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