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spsann (version 2.2.0)

objSPSANN: Auxiliary tools

Description

Auxiliary tools used in the optimization of sample configurations using spatial simulated annealing.

Usage

objSPSANN(osc, at = "end", n = 1)

Arguments

osc

Object of class OptimizedSampleConfiguration.

at

Point of the optimization at which the energy state should be returned. Available options: "start", for the start, and "end", for the end of the optimization. Defaults to at = "end".

n

Number of instances that should be returned. Defaults to n = 1.