Avoiding degenerate MO energy

• Reporter: mikiya_fujii
• 소유자: mikiya_fujii
• Type: Bugs
• Status: Closed
• Component: (None)
• MileStone: ver0.4.0
• Priority: 5 - Medium
• Severity: 5 - Medium
• Resolution: Fixed
• File: None

Details

Avoiding numerical instability in calculating excited force, due to degenerate of MO energy.

Ticket History (3/3 Histories)

2016-01-28 22:15 Updated by: mikiya_fujii

• New Ticket "Avoiding degenerate MO energy" created

2016-01-28 22:22 Updated by: mikiya_fujii

• Details Updated

2016-01-28 22:37 Updated by: mikiya_fujii

• Resolution Update from None to Fixed
• Status Update from Open to Closed
• Ticket Close date is changed to 2016-01-28 22:37

댓글 올리기

fixed at r1807