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An Efficient Dimer Method With Preconditioning And Linesearch

Published 10 Jul 2014 in math.OC, cond-mat.mtrl-sci, math.NA, and physics.atom-ph | (1407.2817v2)

Abstract: The dimer method is a Hessian-free algorithm for computing saddle points. We augment the method with a linesearch mechanism for automatic step size selection as well as preconditioning capabilities. We prove local linear convergence. A series of numerical tests demonstrate significant performance gains.

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