The nudged elastic membrane method builds reduced 2D potential energy surfaces from energies and forces, capturing reaction paths and a previously unreported second-order saddle point in triplet formaldehyde.
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Nudged Elastic Membranes for Constructing Reduced Two-Dimensional Potential Energy Surfaces
The nudged elastic membrane method builds reduced 2D potential energy surfaces from energies and forces, capturing reaction paths and a previously unreported second-order saddle point in triplet formaldehyde.