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| Link | Post Time | Author | Message Excerpt |
|---|---|---|---|
| 276 | 02 Aug 2006, 04:08 PM CEST | Olivier Visser | If you have a reasonable starting point, and a good hessian, ADF should normally have no problems locating the TS. It you may also need to use a better numerical integration accuracy than for simple geometry optimizations.
You probably are aware of the TS documentation in the ADF User's Guide: We do not have list of literature references regarding this issue. Comments from other ADF users are welcome. |
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Received on 2006-08-03 07:00:00This archive was generated by hypermail 2.2.0 : 2006-11-02 07:00:02 CET