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Natural SciencesMaterials EngineeringMaterials ScienceComputational ChemistryComputational Materials ScienceMaterials ChemistryAb Initio MethodsAlloysCluster ChemistryEnergy MinimizationGlobal OptimizationSurface EnergeticsAb Initio Potential Energy SurfacesConvergenceEnergy Landscape AnalysisGenetic Algorithm OptimizationLocal Energy MinimaLocal OptimizationLocal Search OptimizationPotential Energy Surface Optimization
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