Author/Authors :
Erkoç، نويسنده , , ?. and Ba?tu?، نويسنده , , T. and Hirata، نويسنده , , M. and Tachimori، نويسنده , , S.، نويسنده ,
Abstract :
Considering the chemisorption of atomic oxygen on Li(001) surface, the size dependence in adsorption on the model surfaces has been investigated. All-electron density functional calculations within the local density approximation have been applied to cluster models with increasing size. The influence of cluster size on the physics and chemistry of adsorption has been investigated.