| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5383301 | Chemical Physics Letters | 2012 | 5 Pages |
Abstract
⺠Method to improve convergence of a genetic algorithm for cluster structure search. ⺠Mix computed and experimental data in the objective function of the genetic algorithm. ⺠Computed data: DFT energies. ⺠Experimental data: gas phase electron diffraction profile. ⺠Method tested for systems which are known to be difficult for a genetic algorithm.
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Authors
Christian Neiss, Detlef Schooss,