Computational methods for large systems electronic structure approaches for biotechnology and nanotechnology

"While its results normally complement the information obtained by chemical experiments, computer computations can in some cases predict unobserved chemical phenomena Electronic-Structure Computational Methods for Large Systems gives readers a simple description of modern electronic-structure t...

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Detalles Bibliográficos
Otros Autores: Reimers, Jeffrey R. (-)
Formato: Libro electrónico
Idioma:Inglés
Publicado: Hoboken, N.J. : Wiley 2011.
Materias:
Acceso en línea:https://recursos.uloyola.es/login?url=https://accedys.uloyola.es:8443/accedix0/sitios/ebook.php?id=179647
Ver en Universidad Loyola - Universidad Loyola Granada:https://colectivo.uloyola.es/Record/ELB179647
Solicitar por préstamo interbibliotecario: Correo
Tabla de Contenidos:
  • A. DFT : the basic workhorse
  • B. Higher-accuracy methods
  • C. More-economical methods
  • D. Advanced applications.