[Pw_forum] MgH2 (input file)

[Lorenzo Paulatto]

On Wed, 19 Oct 2011 15:40:04 +0200, Winfred Mulwa <mulwawinfred at gmail.com>  
wrote:
> in  xcrysden,there is bonding between two magnesium

Dear Mulwa,
in xcrysden the bond is draw when two atoms are closer than a certain  
threshold; you can change this threshold somewhere in the options.

However keep in mind that, whatever xcrysden draws, it does not influence  
the chemical properties of the material.

bests

-- 
Lorenzo Paulatto IdR @ IMPMC/CNRS & Université Paris 6
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