[Pw_forum] About missing q-points in q2r.in

[Mozahar Ali]

Dear all users,I have run elph.out successfully but while i am going to run q2r.in an error messege is found i.e  from init : error # 1
> > missing q-point(s)!
> > stopping ...
Does anyone could tell me how to avoid this error ?

Thanks in advance
Here my input files under yours consideration.
scf input&control
    prefix='BC3'
    restart_mode='from_scratch',
    calculation = 'scf'
    pseudo_dir = '/home/nahid/espresso-4.0.4/pseudo/'
    outdir='/home/nahid/Mozahar/bc3ph/tmp/'
    tprnfor=.true.
    tstress = .true.
 /
 &system    
    ibrav= 6, a=3.530109,  c=3.895778, nat=8, ntyp= 2,
    ecutwfc =50.0, ecutrho =400.0,
    occupations='smearing', smearing='m-v',degauss =0.02,
 /
 &electrons
   diagonalization= 'cg' ,
    mixing_mode = 'plain'
    mixing_beta = 0.7
    conv_thr =  1.0d-8
 /
ATOMIC_SPECIES
B  10.81000   B.pw91-n-van_ak.UPF 
C  12.0107    C.pw91-van_ak.UPF
ATOMIC_POSITIONS {crystal}
  B      0.50000000     0.0000000      0.5000000    
  B      0.00000000    -0.5000000     -0.5000000   
  C      0.00000000     0.0000000      0.0000000
  C      0.25000000     0.2500000      0.2290000
  C     -0.25000000    -0.2500000      0.2290000
  C      0.25000000    -0.2500000     -0.2290000
  C     -0.25000000     0.2500000     -0.2290000
  C      0.50000000     0.5000000      0.0000000 
K_POINTS automatic 
6 6 6 0 0 0
scf.fit input
&control
    calculation ='scf'
    restart_mode='from_scratch',
    prefix='BC3'
    pseudo_dir = '/home/nahid/espresso-4.0.4/pseudo/'
    outdir='/home/nahid/Mozahar/bc3ph/tmp/'
 /
 &system    
    ibrav= 6, a=3.530109,  c=3.895778, nat=8, ntyp= 2,
    ecutwfc =50.0, ecutrho =400.0,
    occupations='smearing', smearing='m-v',degauss =0.02,
    la2F = .true., 
 /
 &electrons
    mixing_beta = 0.7
    conv_thr =  1.0d-8
 /
ATOMIC_SPECIES
B  10.81000   B.pw91-n-van_ak.UPF 
C  12.0107    C.pw91-van_ak.UPF
ATOMIC_POSITIONS {crystal}
  B      0.50000000     0.0000000      0.5000000    
  B      0.00000000    -0.5000000     -0.5000000   
  C      0.00000000     0.0000000      0.0000000
  C      0.25000000     0.2500000      0.2290000
  C     -0.25000000    -0.2500000      0.2290000
  C      0.25000000    -0.2500000     -0.2290000
  C     -0.25000000     0.2500000     -0.2290000
  C      0.50000000     0.5000000      0.0000000
K_POINTS automatic 
12 12 12 0 0 0
elph.input
 Electron-phonon coefficients for BC3
 &inputph
  tr2_ph=1.0d-14,
  prefix='BC3',
  fildvscf='BC3dv',
  amass(1)=10.810,
  amass(2)=12.0107
  outdir='/home/nahid/Mozahar/bc3ph/tmp/'
  fildyn='BC3.dyn',
  recover=.false.,
  elph=.true.,
  trans=.true.,
  ldisp=.true.
  nq1=3, nq2=3, nq3=3,
Mozahar
Department of physics,Rajshahi University, Rajshahi Bangladesh.


      New Email names for you! 
Get the Email name you've always wanted on the new @ymail and @rocketmail. 
Hurry before someone else does!
http://mail.promotions.yahoo.com/newdomains/aa/
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20090909/a59db376/attachment.html>