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Old 11-01-2010, 06:10 PM
Yann Pouillon
 
Default Bug#602126: ITP: python-ase -- Atomic Simulation Environment

Package: wnpp
Severity: wishlist
Owner: Yann Pouillon <yann.pouillon@gmail.com>

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* Package name : python-ase
Version : 3.4.1
Upstream Author : Ask Hjorth Larsen <askl@fysik.dtu.dk>
* URL : https://wiki.fysik.dtu.dk/ase/
* License : GPL, LGPL
Programming Lang: Python
Description : Atomic Simulation Environment

The Atomic Simulation Environment (ASE) is the common part of the
simulation tools developed at CAMd. ASE provides Python modules for
manipulating atoms, analyzing simulations, visualization, and wrapping
electronic-structure codes.
..
It currently supports ABINIT, ASAP, DFTB, ELK, EXCITING, EMT, FHI-AIMS,
FLEUR, GPAW, HOTBIT, JACAPO, SIESTA, and TURBOMOLE.

This package will be part of the Debian Science nanoscale-physics
metapackage.


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