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Atomic structure prediction of nanostructures, clusters and surfaces /

This work fills the gap for a comprehensive reference conveying the developments in global optimization of atomic structures using genetic algorithms. Over the last few decades, such algorithms based on mimicking the processes of natural evolution have made their way from computer science discipline...

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Detalles Bibliográficos
Clasificación:Libro Electrónico
Autor principal: Ciobanu, Cristian V.
Otros Autores: Wang, Cai-Zhuang, Ho, Kai-Ming
Formato: Electrónico eBook
Idioma:Inglés
Publicado: Weinheim, Germany : Wiley-VCH Verlag Gmbh, ©2013.
Temas:
Acceso en línea:Texto completo
Tabla de Contenidos:
  • The challenge of predicting atomic structure
  • The genetic algorithm in real-space representation
  • Crystal structure prediction
  • Optimization of atomic clusters
  • Atomic structure of surfaces, interfaces, and nanowires
  • Other methodologies for investigating atomic structure
  • Perspectives and outlook
  • Index.