Conjugate-directions method for finding saddle points
โ Scribed by Yu. M. Danilin; V. M. Panin
- Publisher
- Springer US
- Year
- 1976
- Tongue
- English
- Weight
- 443 KB
- Volume
- 10
- Category
- Article
- ISSN
- 1573-8337
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## Abstract The predictorโcorrector method for following a reduced gradient (RGF) to determine saddle points [Quapp, W. et al., J Comput Chem 1998, 19, 1087] is further accelerated by a modification allowing an implied corrector step per predictor but almost without additional costs. The stability
We present an algorithm which can be used to find saddle points of non-linear functionals or functions with a large number of variables. The saddle points that can be found have only one unstable direction. The algorithm is tested on a "~" functional and yields the well known circular "critical drop