[Molds-dev] [molds] #30327: Segmentations fault for odd valence electron systems

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SourceForge Ticket System norep****@sourc*****
2012年 12月 17日 (月) 14:42:22 JST


#30327: Segmentations fault for odd valence electron systems

  Open Date: 2012-12-17 14:42
Last Update: 2012-12-17 14:42

URL for this Ticket:
    http://sourceforge.jp/ticket/browse.php?group_id=6231&tid=30327
RSS feed for this Ticket:
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Last Changes/Comment for this Ticket:
2012-12-17 14:42 Update by: mikiya_fujii

 * New Ticket "Segmentations fault for odd valence electron systems" created

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Ticket Status:

      Reporter: mikiya_fujii
         Owner: mikiya_fujii
          Type: バグ
        Status: オープン
      Priority: 3
     MileStone: ver0.3.0
     Component: (未割り当て)
      Severity: 3
    Resolution: なし
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Ticket details:

Segmentations fault for systems which has odd valence electrons.
The below input occurs this bug.

{{{
THEORY
  pm3/pddg
THEORY_END

GEOMETRY
H         -2.48669        3.36622      -20.91326
H         -0.25125        4.01977       21.23949
H          2.00299        3.61523      -21.13212
GEOMETRY_END
}}}



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