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lcl19870223

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×îºóÒ»²½³ö´í£¬ÐÅÏ¢£ºCannot find PCM informations on the checkpoint file.
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gkf¸ß: ½ð±Ò+2 2013-11-29 15:27:06
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2Â¥2013-11-29 08:05:08
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lcl19870223

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%chk=06.chk
# B3LYP/6-311G(d,p) TD=(Read,NStates=6,Root=1)
  SCRF=(Solvent=water,ExternalIteration,Read)
  Geom=Check Guess=Read

3-aminophtalate ion: emission state-specific solvation
at first excited state optimized geometry

-2 1

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%chk=07.chk
# B3LYP/6-311G(d,p) SCRF=(Solvent=water,Read)
  Geom=Check Guess=Read

3-aminophtalate ion: ground state non-equilibrium
at excited state geometry

-2 1

NonEq=read
3Â¥2013-11-29 09:17:27
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