help

[celio angel]

Hi Conard, I ask you if i add this section it's enough to make this 
multiplicite in positive direction 
&TOPOLOGY
        MULTIPLE_UNIT_CELL 2 2 1
        &CENTER_COORDINATES
          CENTER_POINT 0. 0. 0.
        &END
        &END TOPOLOGY
     &CELL
     ABC 4.57000000 4.57000000 4.57000000
     ALPHA_BETA_GAMMA 90 90 90
     MULTIPLE_UNIT_CELL 2 2 1
     &END CELL
thank you 

Le mardi 8 mars 2016 15:27:10 UTC+1, celio angel a écrit :
>
> Dear all users of CP2K.are you any way  to specialize in the  section 
> multiple unit cell  to make this multiplicity in the direction positive so 
> that the positions atomic will have positive fractions.and thank you.
>
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