Ok, I am confused again.
I used ibrav=0 in the scf run that eventually gave me the error in matdyn.x.
I am running it again. This time I've used,
ibrav = 6,
celldm(1) = [..]
celldm(3) = [..]
in the scf. It's good to know if this is more possible to work as ph.x
takes about 4 days.
Quoting Lorenzo Paulatto <paul...@gmail.com>:
> On 02/19/2018 03:14 PM, Saif Ullah wrote:
>> Dear Eleni,
>> Did you use ibrav=0? If so, then you need to use q_in_band_form=.false.
> Neither of these two bits of advice is correct:
> 1. q_in_band_form can be used with ibrav=0 as usual, and works just as
> well as long as you specify the point coordinates
> 2. there is no specific reason to use crystal coordinates with ibrav=0,
> you can, as usual, but by no mean you "need to"
> kind regards
> Lorenzo Paulatto - Paris
> Pw_forum mailing list
Dr. Eleni Chatzikyriakou
Computational Physics lab
Aristotle University of Thessaloniki
elch...@auth.gr - tel:+30 2310 998109
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