1995•Unpublished venueRequires access

Second-Order Methods for the Optimization of Molecular Potential Energy Surfaces

Trygve Helgaker, Kenneth Ruud, Peter R. Taylor

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Key concepts: Saddle point, Maxima and minima, Potential energy surface, Potential energy, Ab initio, Stationary point, Computational chemistry, Quantum chemistry

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Second-Order Methods for the Optimization of Molecular Potential Energy Surfaces — Research Paper | ScholarLens