Calculation of surface stress for fcc transition metals

ABSTRACT: Using the density functional theory, formulated within the framework of the exact muffin-tin orbitals method, we have calculated the surface stress for the (111) free surfaces of the fcc 4d and 5d transition metals. Good agreement is obtained with the available ab initio data for Pd, Ir, a...

Full description

Autores:
Osorio Guillén, Jorge Mario
Vitos, Levente
Kollár, János
Ahuja, Rajeev
Tipo de recurso:
Article of investigation
Fecha de publicación:
2003
Institución:
Universidad de Antioquia
Repositorio:
Repositorio UdeA
Idioma:
eng
OAI Identifier:
oai:bibliotecadigital.udea.edu.co:10495/8636
Acceso en línea:
http://hdl.handle.net/10495/8636
Palabra clave:
Cálculo
Metales
Transiciones
Transición metal
Rights
openAccess
License
Atribución-NoComercial-SinDerivadas 2.5 Colombia