I am trying to calculate vc-relax of (2,2) Carbon Nanotube in Quantum Espresso. I have simulated it many times but the same error occurred. For your clear understanding, I give relax input file.
&CONTROL
calculation = "vc-relax"
restart_mode = 'from_scratch'
outdir = 'cnt_relax'
pseudo_dir = '/home/user/Desktop/latif/pseudo',
prefix = 'calc_relax' ,
/
&SYSTEM
a = 2.28702e+01
c = 2.46180e+00
degauss = 1.00000e-02
ecutrho = 480
ecutwfc = 40
ibrav = 4
nat = 8
ntyp = 1
occupations = "smearing"
smearing = "gaussian"
/
&ELECTRONS
conv_thr = 1.00000e-04
mixing_beta = 7.00000e-01
startingpot = "atomic"
startingwfc = "atomic+random"
/
&IONS
ion_dynamics = "bfgs"
/
&cell
cell_dynamics = "bfgs",
/
K_POINTS {automatic}
3 3 3 0 0 0
ATOMIC_SPECIES
C 12.01060 C.pbe-rrkjus.UPF
ATOMIC_POSITIONS {angstrom}
C 1.402181 -0.000000 -1.233916
C 0.682146 1.225067 -1.233916
C -0.000000 1.402181 0.000000
C -1.225067 0.682146 0.000000
C -1.402181 -0.000000 -1.233916
C -0.682146 -1.225067 -1.233916
C -0.000000 -1.402181 0.000000
C 1.225067 -0.682146 0.000000