[Wien] reciprocal lattice vectors in case.output1

[fatemeh.mirjani]

Dear Users;

I want to extract PW-expansion coefficients that are written into case.output1
I don't know why some reciprocal lattice vectors are written twice for 1 k-point with 2 energy like these data:

 RECIPROCAL LATTICE VECTORS

                    1.ENERGY   2.ENERGY   3.ENERGY   4.ENERGY   5.ENERGY   6.ENERGY   7.ENERGY

  -1  -1  -1
                   0.122365   0.403507   0.009077  -0.303482   0.593421  -0.015253   0.113373
   0   0   0
                  -0.122365  -0.403507  -0.009077  -0.303482   0.593421  -0.015253   0.113373
  -1  -1   0
                   0.308082   0.047121   0.284146  -0.303482  -0.252181   0.455154   0.307367
  -1   0  -1
                  -0.327413   0.243847   0.105891  -0.303482  -0.251284  -0.522296   0.171167
  -1   0   0
                  -0.141697  -0.112540   0.380960  -0.303482  -0.089956   0.082395  -0.591907
   0  -1  -1
                   0.141697   0.112540  -0.380960  -0.303482  -0.089956   0.082395  -0.591907
   0  -1   0
                   0.327413  -0.243847  -0.105891  -0.303482  -0.251284  -0.522296   0.171167
   0   0  -1
                  -0.308082  -0.047121  -0.284146  -0.303482  -0.252181   0.455154   0.307367
  -1  -1  -1
                   0.000000   0.000000   0.000000   0.019880   0.000000   0.000000   0.000000
  -1  -1  -1
                   0.000000   0.000000   0.000000  -0.233643   0.000000   0.000000   0.000000
  -1  -1  -1
                  -0.007745  -0.015135   0.010907   0.000000   0.000000   0.000000   0.000000
  -1  -1   0
                  -0.004880   0.001919  -0.019507   0.000000   0.000000   0.000000   0.000000
  -1   0  -1
                   0.013759  -0.003851  -0.014279   0.000000   0.000000   0.000000   0.000000

  0.500000  0.500000  0.500000    7   13
       NUMBER OF K-POINTS:           4
   ===> TOTAL CPU       TIME:      0.0 (INIT =      0.0 + K-POINTS =      0.0)
   > SUM OF WALL CLOCK TIMES:      0.1 (INIT =      0.1 + K-POINTS =      0.0)
      Maximum WALL clock time:   0.110247135162354
     Maximum CPU time:          8.000000000000000E-002

Any help is appreciated.


-- 
Best Regards
Fatemeh Mirjani
Computational Condensed Matter Research Lab.
Affiliated ICTP Center,
Physics Department, Isfahan University of Technology, Iran
Email: f_mirjani at ph.iut.ac.ir 
Tel/Fax Office: +98311-3913746
Tel Lab.: +98311-3913731
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