Dear comrade QE users
I intended to calculate the phonon dispersion curve for cBN as a prelude to
other materials. I have included the epsil = .true. and trans = .true. in my
input to obtain the LO-TO splitting and dielectric tensor. I kept getting the
error as shown. Any assistance will be appreciated greatly
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
task # 0
from phq_readin : error # 5010
reading inputph namelist
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Below is my input file
&INPUTPH
tr2_ph=1.0d-14,
recover = .true.,
amass(1)=10.811,
amass(2)=14.001,
prefix='BN',
espil=.true.,
trans = .true.,
ldisp=.true.,
outdir='/home/musty/esp/BN/PBE(2)/PHONON',
fildyn='dyn',
nq1=4, nq2=4, nq3=4
/
Mustapha L.O ,
Graduate Student, Department of Physics
University of Ibadan.
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