File: elk.in

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elkcode 10.4.9-1
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file content (43 lines) | stat: -rw-r--r-- 432 bytes parent folder | download | duplicates (2)
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tasks
 0
 205
 210
 500

test
 .true.

wplot
  200 100 10
  0.0 1.0

swidth
  0.01

lmaxi
  2

ngridq
  2  2  2

ngridk
  4  4  4

avec
  1.0  1.0 -1.0
  1.0 -1.0  1.0
 -1.0  1.0  1.0

scale
  3.118

sppath
 '../../species/'

atoms
  1                                   : nspecies
  'Nb.in'                             : spfname
  1                                   : natoms
  0.0  0.0  0.0    0.0  0.0  0.0      : atposl, bfcmt