[Pw_forum] CRASH of ph.x calculation in example06
lan haiping
lanhaiping at gmail.com
Sun Aug 27 13:27:17 CEST 2006
Dear all,
I wanna obtain phonon spectrum of the irreducible BZ, then i tried to run
$(espresso)/examples/example06.
But the code came to crash for matrix diagonalization error, and just
gave alas.dyn0, alas.dyn1, alas.dyn2 files .
I then just changed the k_points in scf calculation from 2 points to
mkgrid (4,4,4, 0,0,0), and the calculation can be finished sucessfully.
so, i would like to know whether this error is due to math-lib or k-point
setting in scf calculation ?
Regards,
Hai-Ping
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