[Wien] ElaStic_1.0 is Available

[Peter Blaha]

It is already for some time at the www.wien2k.at-"reg_user/unsupported 
software" page !

On 06/19/2013 05:05 PM, Rostam Golesorkhtabar wrote:
> Dear Prof. Blaha and WIEN2k users,
>
> I am happy to announce here the first version of the ElaStic code is
> available. ElaStic is an open-source Python implementation for the
> calculations of elastic constants of crystalline materials. It can be
> used to obtain full second-order elastic tensors for all crystal lattice
> types and third-order elastic tensors for cubic, hexagonal, and
> rhombohedral crystals. The package has a rich set of features for
> transforming the elastic constants into any Cartesian coordinate system
> and computing elastic moduli with different averaging methods. ElaStic
> is interfaced with the density-functional codes exciting, *WIEN2k*, and
> Quantum Espresso for computing the energy and stress matrices of
> deformed crystals. ElaStic can be downloaded from
> http://exciting-code.org/elastic <http://exciting-code.org/elastic>
> together with its documentation and recently published paper.
>
> Best Wishes,
> Rostam Golesorkhtabar
>
>
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-- 

                                       P.Blaha
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Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-1-58801-165300             FAX: +43-1-58801-165982
Email: blaha at theochem.tuwien.ac.at    WWW: 
http://info.tuwien.ac.at/theochem/
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