[Wien] wien2k_14.2

Peter Blaha pblaha at theochem.tuwien.ac.at
Thu Oct 16 16:26:54 CEST 2014


Dear wien2k users,

Following the suggestions during the discussions at the last wien2k 
workshop, I'd like to release a new version,

wien2k_14.2

It contains fixes to all comments/problems/bugs mentioned recently on 
the mailing list, as well as some enhancements for nn (atoms at 
identical positions detected), w2w, 2DRoptimize, nmr.

Besides that, it should be an IMPORTANT update for all   w2web  users, 
as this interface has been significantly enhanced (in particular for the 
"TASKs" section, but also removing the "-c" problem, ...).

Regards
-- 

                                       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    WIEN2k: http://www.wien2k.at
WWW:   http://www.imc.tuwien.ac.at/staff/tc_group_e.php
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