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. Eleni Quoting Lorenzo Paulatto <[email protected]>: > 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. >> q_in_cryst_coord=.true. >> > 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 > [email protected] > http://pwscf.org/mailman/listinfo/pw_forum -- Dr. Eleni Chatzikyriakou Computational Physics lab Aristotle University of Thessaloniki [email protected] - tel:+30 2310 998109 _______________________________________________ Pw_forum mailing list [email protected] http://pwscf.org/mailman/listinfo/pw_forum
