hello all,

i am currently trying to obtain phonon spectra using Vibra utility. i took
a 2x2x0 graphene supercell with 50 atoms and run it obtained a *.FC file
with 600 rows. But on running vibrator i got the following error

Computing Eigenvalues and Eigenvectors
At line 322 of file vibrator.f (unit = 12, file = 'graf.FC')
Fortran runtime error: End of file


can anybody tell what may be the possible reason.. any help is highly
acknowledged...


thanks

pooja

Responder a