%0 Journal Article
%T First principles calculations of relationship between the Cu surface states and relaxations<br>First principles calculations the Cu surface states of relationship between and relaxations
%A Xie Yao-Ping
%A Luo Ying
%A Liu Shao-Jun
%A <br>谢耀平
%A 罗莹
%A 刘绍军
%J 中国物理 B
%D 2007
%I 
%X In this paper the relationship between the surface relaxations and the electron density distributions of surface states of Cu(100), Cu(110), and Cu(111) surfaces is obtained by first-principles calculations. The calculations indicate that relaxations mainly occur in the layers at which the surface states electrons are localized, and the magnitudes of the multilayer relaxations correspond to the difference of electron density of surface states between adjacent layers. The larger the interlayer relaxation is, the larger the difference of electron density of surface states between two layers is.
%K surface states
%K relaxations
%K first-principles calculation<br>铜
%K 表面状态
%K 弛豫作用
%K 相关性
%K 第一原理计算
%U http://www.alljournals.cn/get_abstract_url.aspx?pcid=6E709DC38FA1D09A4B578DD0906875B5B44D4D294832BB8E&cid=47EA7CFDDEBB28E0&jid=CD8D6A6897B9334F09D8D1648C376FB4&aid=51EC29F0F1FE4796D9B241B1ABF0B2C2&yid=A732AF04DDA03BB3&vid=7801E6FC5AE9020C&iid=94C357A881DFC066&sid=563A479A59477CAE&eid=1E0D46E7B42E2E81&journal_id=1009-1963&journal_name=中国物理&referenced_num=0&reference_num=30