Cargando…

Nanomaterials : design and simulation /

Over the past few decades, several approaches have been developed for designing nano-structured or molecularly-structured materials. These advances have revolutionized practically all fields of science and engineering, providing an additional design variable, the feature size of the nano-structures,...

Descripción completa

Detalles Bibliográficos
Clasificación:Libro Electrónico
Otros Autores: Balbuena, Perla B., Seminario, J. M.
Formato: Electrónico eBook
Idioma:Inglés
Publicado: Amsterdam ; Boston : Elsevier, 2007.
Edición:1st ed.
Colección:Theoretical and computational chemistry ; 18.
Temas:
Acceso en línea:Texto completo
Texto completo
Texto completo
Tabla de Contenidos:
  • 1. Electrical Characteristics of Bulk-Molecule Interfaces / P.B. Balbuena [and others]
  • 2. Structural Properties of Pure and Binary Nanoclusters Investigated by Computer Simulations / G. Rossi, R. Ferrando
  • 3. Computer Simulation of the Solid-Liquid Phase Transition in Alkali Metal Nanoparticles / A. Aguado, J. Lopez
  • 4. Multiscale Modeling of Quantum Nanodots and their Arrays / Narayan Adhikari [and others]
  • 5. Structural Characterization of Nano- and Mesoporous Materials by Molecular Simulations / L.F. Vega
  • 6. Hydrogen Adsorption in Corannulene-Based Materials / Yingchun Zhang [and others]
  • 7. Toward Nanomaterials: Structural, Energetic and Reactivity Aspects of Single-Walled Carbon
  • Nanotubes / T.C. Dinadayalane, J. Leszczynski
  • 8. Thermal Stability of Carbon Nanosystems: Molecular-Dynamics Simulations / �Sakir Erk�o�c
  • 9. Modeling and Simulation of Carbon Nanotubes / A. Buldum
  • 10. Nano-Confined Water / A. Striolo
  • 11. Ab Initio Simulations of Photoinduced Molecule-Semiconductor Electron Transfer / W.R. Duncan [and others]
  • 12. Nano Particulated Photocatalysts for Overall Water Splitting under Visible Light / Kazuhiko Maeda, Kazunari Domen).