[Wien] Optimal lattice constants in orthorombic structure ?

[Gavin Abo]

You can use the script parabolfit_lapw [ 
https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg11268.html 
].  Refer to the WIEN2k 14.2 usersguide (section "5.10.3 
parabolfit_lapw") [ 
http://www.wien2k.at/reg_user/textbooks/usersguide.pdf ].

On 6/24/2015 1:42 AM, Marzieh Gh wrote:
>
> Dear professor Blaha
>
> I use option 6 of optimization to optimize lattice constants of 
> orthorombic structure.
>
> Optimallattice constants (a, b, c) are in which output file? Or how to 
> find them?
>
> Best Regard
>
>
>
> -- 
> Marzieh Ghoohestani
> PhD Student of Computational Nano Physics
> Nano Research Center, Department of Physics
> University of Technology, Isfahan, Iran