[Wannier] Regarding Spin-orbit coupling calculation in VASP5.4.4 with wannier90-2.0.1

[pachineela rambabu]

Dear wannier90 users,
                               I am trying to calculate the bandstructure
of a binary compound *AX* with VASP.5.4.4to wannier90-2.0.1. I have done
scf calculation in VASP and during nscf calculation, I gave the following
in INCAR:


*
ISTART =
1;
  ICHARG = 11;*

*
NBANDS = 96;*

*
LSORBIT = .TRUE.*

*
LWANNIER90 =
.TRUE.
LWRITE_MMN_AMN = .TRUE.*

Also I made the wannier90.win file which contains the following:








*
begin
projections
A : s; px; py; pz; dxy; dyz; dxz; dx2-y2;
dz2
X  : s; px; py;
pz
end projections
                                   num_bands=    96

num_wann =    13
                                      spinors = .true.*

When I run the calculation with vasp_ncl,it is giving following error:









































































* LDA part: xc-table for Pade appr. of Perdew POSCAR, INCAR and KPOINTS ok,
starting setup FFT: planning ... WAVECAR not read entering main loop
N       E                     dE             d eps       ncg
rms          rms(c)DAV:   1     0.173292417271E+03    0.17329E+03
-0.45606E+03832880   0.383E+02DAV:   2     0.102542135703E+01
-0.17227E+03   -0.14929E+03869792   0.152E+02DAV:   3
-0.153255423290E+02   -0.16351E+02   -0.15504E+02998112   0.496E+01DAV:
4    -0.156308114000E+02   -0.30527E+00   -0.30400E+00******
0.667E+00DAV:   5    -0.156350969360E+02   -0.42855E-02
-0.42845E-02******   0.666E-01    0.818E+00DAV:   6
-0.159099972360E+02   -0.27490E+00   -0.92851E-01******   0.553E+00
0.184E+00DAV:   7    -0.159152495406E+02   -0.52523E-02
-0.41476E-02******   0.102E+00    0.102E+00DAV:   8
-0.159081830533E+02    0.70665E-02   -0.10847E-02******   0.581E-01
0.519E-01DAV:   9    -0.159082175772E+02   -0.34524E-04
-0.26205E-03******   0.202E-01    0.117E-01DAV:  10
-0.159083532455E+02   -0.13567E-03   -0.50433E-04******   0.951E-02
0.734E-02DAV:  11    -0.159082251449E+02    0.12810E-03
-0.50372E-05******   0.303E-02    0.160E-02DAV:  12
-0.159082224057E+02    0.27392E-05   -0.64819E-06******   0.106E-02
0.825E-03DAV:  13    -0.159082224594E+02   -0.53658E-07
-0.51464E-06******   0.735E-03 Projection   1 done. Projection   2
done. Projection   3 done. Projection   4 done. Projection   5
done. Projection   6 done. Projection   7 done. Projection   8
done. Projection   9 done. Projection  10 done. Projection  11
done. Projection  12 done. Projection  13 done. Projection  14
done. Projection  15 done. Projection  16 done. Projection  17
done. Projection  18 done. Projection  19 done. Projection  20
done. Projection  21 done. Projection  22 done. Projection  23
done. Projection  24 done. Projection  25 done. Projection  26
done. Projection  27 done. Projection  28 done. Projection  29
done. Projection  30 done. Projection  31 done. Projection  32
done. Projection  33 done. Projection  34 done. Projection  35
done. Projection  36 done. Projection  37 done. Projection  38
done. Projection  39 done. Projection  40 done. Projection  41
done. Projection  42 done. Projection  43 done. Projection  44
done. Projection  45 done. Projection  46 done. Projection  47
done. Projection  48 done. Projection  49 done. Projection  50
done. Projection  51 done. Projection  52 done. MLWF_WANNIER90: ERROR:
number of projections not equal to num_wann          52          26*

Please rectifiy my problem. I hope I will get reply as soon as possible.

Sincerely,
-- 
*P. Rambabu*
PhD Scholor
Physics, IIT Hyderabad
Mobile: 9074508220.
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