the in plane lattice parameter is determined by the bulk.
the atomic positions are determined by relaxation.
beware of the possibility of surface reconstruction, especially for semiconductors.

stefano

On 11/01/2016 10:25, ilahi asma wrote:
Hello all,
I'm studing The LiF(001) fcc structure.how to choose the lattice parameter?? is it the same of the bulk ????
Best regards.


 ********************************************************
 Ilahi Asma ,
 Phd.student,
 UR "Physical Properties of Heterostructures ",
 PhysicsDepartment,Faculty of Sciences Tunis,
 Campus University, 2092 Manar, Tunis,Tunisia.
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