Sinopsis de Computational quantum mechanics for materials engineers: the EMTO method and applications

Traditionally, new materials have been developed by empirically correlating their chemical composition, and the manufacturing processes used to form them, with their properties. Until recently, metallurgists have not used quantum theory for practical purposes. However, the development of modern density functional methods means that today, computational quantum mechanics can help engineers to identify and develop novel materials. ‘Computational Quantum Mechanics for Materials Engineers’ describes new approaches to the modelling of disordered alloys that combine the most efficient quantum-level theories of random alloys with the most sophisticated numerical techniques to establish a theoretical insight into the electronic structure of complex materials such as stainless steels, Hume-Rothery alloys and silicates. The practical success of these approaches to applications in all of these areas are covered in detail. Only book t...

Otros libros de Ciencia de los materiales

• 
  Ciència dels materials.
  Autor: Cruells,E..
  ISBN: 978-84-475-3178-3.
  Editorial: SPRINGER LONDON
  
  
• 
  Ciencia de materiales (mecánica).
  Autor: García Ledesma, Ricardo.
  ISBN: 978-84-86451-21-9.
  Editorial: SPRINGER LONDON
  
  
• 
  Ciencias e ingeniería de los materiales.
  Autor: Askeland, Donald R..
  ISBN: 978-968-7529-36-3.
  Editorial: SPRINGER LONDON
  
  
• 
  Computational fluid dynamics: the basics with applications.
  Autor: Anderson, John D..
  ISBN: 978-0-07-001685-9.
  Editorial: SPRINGER LONDON
  
  
• 
  Cuestiones de materiales ópticos.
  Autor: Bonmati, A..
  ISBN: 978-84-7908-195-9.
  Editorial: SPRINGER LONDON