   ISPIN  =      2    spin polarized calculation?
  energy  without entropy=     -713.15248471  energy(sigma->0) =     -713.15422542
  energy  without entropy=     -713.14470133  energy(sigma->0) =     -713.14741305
  energy  without entropy=     -713.11156701  energy(sigma->0) =     -713.11610301
  energy  without entropy=     -713.63841271  energy(sigma->0) =     -713.63841271
  energy  without entropy=     -713.64437163  energy(sigma->0) =     -713.64437163
  energy  without entropy=     -713.65189172  energy(sigma->0) =     -713.65189172
  energy  without entropy=     -713.65444046  energy(sigma->0) =     -713.65444046
  energy  without entropy=     -713.66128894  energy(sigma->0) =     -713.66128894
  energy  without entropy=     -713.67143194  energy(sigma->0) =     -713.67143194
  energy  without entropy=     -713.67702954  energy(sigma->0) =     -713.67702954
  energy  without entropy=     -713.68972964  energy(sigma->0) =     -713.68972964
  energy  without entropy=     -713.72416331  energy(sigma->0) =     -713.72416331
  energy  without entropy=     -713.77607720  energy(sigma->0) =     -713.77607720
  energy  without entropy=     -713.80982813  energy(sigma->0) =     -713.80982813
  energy  without entropy=     -713.81074918  energy(sigma->0) =     -713.81074918
