[Pw_forum] SURFACE RECONSTRUCTION USING RELAX CALCULATION

[mohnish pandey]

Dear users,
                   I want to get the results for surface reconstructions
computationally, but the problem is as we have specify the "ibrav" i.e
symmetry of the system the relax calculation only optimizes the structure
within the given symmetry. Can anybody suggest a way to model
reconstructions .
Thanks in advance,
MOHNISH

-- 
Mohnish Pandey
Y6927262,4th Year dual degree student,
Department of Chemical Engineering,
IIT KANPUR
09235721300
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