$coord file=coord
$atoms
  basis =pob-TZVP-rev2
  jbas  =universal
$periodic 3
$lattice
     -0.00000000105335      5.20436067260470      5.20436067309448
      5.20340476276993      0.00095905325371      5.20340161878460
      5.20583899369893      5.20583579361173     -0.00147512205632
$dft
  functional pbe
  gridsize m5
  weight derivatives
$kpoints
  nkpoints 9 9 9
$scfiterlimit 50
$scfconv 8
$optcell
$last step     riper
$basis file=basis
$jbas file=auxbasis
$xctype GGA (not to be modified here)
$scfmo    file=mos
$closed shells
 a       1-14                                   ( 2 )
$energy      SCF               SCFKIN            SCFPOT
     1 -578.7523090600      578.2307172639     -1156.983026324
$last SCF energy change = -578.75231
$grad          cartesian gradients
  cycle =      1    SCF energy =     -578.7523090600   |dE/dxyz| =  0.000140
    0.00158677683148     -0.00099820297982      0.00099820297765      si
    2.60459809678335      2.60276656817030      2.60159410461295      si
  -.77520282745658D-04  -.43602691419009D-04  0.43603739331211D-04
  0.77520282745658D-04  0.43602691419009D-04  -.43603739331211D-04
$gradlatt
  cycle =      1    energy =     -578.7523090600 |dE/dlatt| =  0.000183
   -.10533500000000D-08 0.52043606726047D+01 0.52043606730945D+01
   0.52034047627699D+01 0.95905325371000D-03 0.52034016187846D+01
   0.52058389936989D+01 0.52058357936117D+01 -.14751220563200D-02
      0.36210180165571D-04 0.33335324269230D-04 0.18107712605480D-04
      -.47616622051463D-04 -.38870418698504D-05 0.38870175858185D-05
      0.13023633681932D-03 0.75865385347437D-04 -.75866387426900D-04
$end
