Cell optimization : z direction constraint

josué Maya maya... at gmail.com
Wed Jun 1 15:07:25 CEST 2016


Hi,
>
>
> As you are talking about cell optimisation, please can you explain to me 
> how I can do a Cell optimization ? I want also to know how to set cell size 
> ? i want to get cell parameter for a dimer of ethanol. 
>
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