[Wien] scf2forces

Rajneesh Chaurasiya rajnano2012 at gmail.com
Fri Feb 12 14:23:11 CET 2016


Dear sir,

I installed the phonopy package for phonon calculation. I have used the
hexagonal ZnO structure for phonon calculation so i make a supercell
(2*2*2) and initialize the structure. after initialization it required to
find the force on the each atom so used scf2forces but it showing some
error which is give below.

 error in opening DISP
 error in opening FORCES
 error in opening *.struct
 error in opening *.scf

so please give me your suggestion.
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