Theoretical and computational aspects of magnetic organic molecules /

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Organic materials with extraordinary magnetic properties promise a wide range of light, flexible, and inexpensive alternatives to familiar metal-based magnets. Individual organic molecules with high magnetic moments will be the foundation for design and fabrication of these materials. This book prov...

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Detalles Bibliográficos
Clasificación:Libro Electrónico
Autores principales: Datta, Sambhu N. (Autor), Trindle, Carl (Autor), Illas, Francesc (Autor)
Formato: Electrónico eBook
Idioma:Inglés
Publicado: London : Imperial College Press, 2013.
Temas:
Magnetochemistry.
Molecular orbitals.
Molecules > Magnetic properties.
Magnétochimie.
Orbitales moléculaires.
SCIENCE > Chemistry > Physical & Theoretical.
Magnetochemistry
Molecular orbitals
Molecules > Magnetic properties
Acceso en línea:Texto completo
Tabla de Contenidos:
  • Introduction to magnetism
  • Organic molecules, radicals, and spin states
  • Theoretical methodologies
  • Molecular orbital description of magnetic organic systems
  • Qualitative methods for predicting molecular spin states
  • Quantum chemical calculations: structural trends
  • Strongly coupled magnetic molecules
  • Photomagnetic effects
  • Transition metal complexes
  • Computational studies of inorganic clusters and solid
  • Systems
  • A look ahead.

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