Segmentations fault for odd valence electron systems

• Rapporteur: mikiya_fujii
• Propriétaire: mikiya_fujii
• Type: Bogues
• État: Atteints
• Composant: (Aucun)
• Jalon: ver0.3.0 (atteints)
• Priorité: 3
• Sévérité: 3
• Résolution: Fixed
• Fichier: Aucun

Détails

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

Ticket History (2/2 Histories)

2012-12-17 14:42 Updated by: mikiya_fujii

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

2012-12-17 14:43 Updated by: mikiya_fujii

• Résolution Update from Aucun to Fixed
• État Update from Ouvert to Atteints
• Ticket Close date is changed to 2012-12-17 14:43

Commentaire

fixed at r1190