Bibliographic Details
| Title: |
Surface diffraction structure determination from combinatorial simultaneous optimization |
| Authors: |
Blanco-Rey, M. maria.blanco@icmm.csic.es, de Andres, Pedro L.1 pedro@icmm.csic.es |
| Source: |
Surface Science. Apr2006, Vol. 600 Issue 7, pL91-L95. 0p. |
| Subjects: |
Optical diffraction, Electron scattering, Combinatorial optimization, Parameter estimation |
| Abstract: |
Abstract: We present a technique to efficiently locate the global minimum of a cost function on a complex multi-dimensional parameter space (e.g. a structural reliability R-factor). The method builds a convergent series of structures from combinatorial simultaneous optimization of all the parameters on different subspaces of the experimental data base. Performance has been tested for two model situations: (1) phase retrieval from electron scattering by a single atom and (2) low-energy electron diffraction analysis of simulated I(V) curves for the Ir(110)-p(2×1) missing row. Compared under the same conditions, a reduction in the computation effort, is found w.r.t. previous state-of-the-art methods (e.g., simulated annealing and genetic algorithms). [Copyright &y& Elsevier] |
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| Database: |
Engineering Source |