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題名 Calculation for a Cu(001) Surface with an Impurity Atom.
作者 楊志開
Yang,Chih-Kai
貢獻者 應物所
日期 1999
上傳時間 25-Sep-2014 11:50:28 (UTC+8)
摘要 I use a self-consistent electronic structure calculation to study the system of Cu(001) that has an impurity atom replacing one of the surface Cu atoms. The calculation makes use of the tight-binding linear muffin-tin orbitals (TB-LMTO) and is carried out in real space. I am able to derive the spin-polarized local densities of states for the impurity Cr and Fe respectively, which have peaks below the Fermi level. Charge transfers between the impurities and their neighbors also result in different distributions of magnetic moments for the two impurity systems, with the Cr having approximately 0.5μB and the Fe atom having a negligible magnetic moment.
關聯 International Journal of Modern Physics B,13(4),389-396
資料類型 article
dc.contributor 應物所en_US
dc.creator (作者) 楊志開zh_TW
dc.creator (作者) Yang,Chih-Kaien_US
dc.date (日期) 1999en_US
dc.date.accessioned 25-Sep-2014 11:50:28 (UTC+8)-
dc.date.available 25-Sep-2014 11:50:28 (UTC+8)-
dc.date.issued (上傳時間) 25-Sep-2014 11:50:28 (UTC+8)-
dc.identifier.uri (URI) http://nccur.lib.nccu.edu.tw/handle/140.119/70152-
dc.description.abstract (摘要) I use a self-consistent electronic structure calculation to study the system of Cu(001) that has an impurity atom replacing one of the surface Cu atoms. The calculation makes use of the tight-binding linear muffin-tin orbitals (TB-LMTO) and is carried out in real space. I am able to derive the spin-polarized local densities of states for the impurity Cr and Fe respectively, which have peaks below the Fermi level. Charge transfers between the impurities and their neighbors also result in different distributions of magnetic moments for the two impurity systems, with the Cr having approximately 0.5μB and the Fe atom having a negligible magnetic moment.en_US
dc.format.extent 349255 bytes-
dc.format.mimetype application/pdf-
dc.language.iso en_US-
dc.relation (關聯) International Journal of Modern Physics B,13(4),389-396en_US
dc.title (題名) Calculation for a Cu(001) Surface with an Impurity Atom.en_US
dc.type (資料類型) articleen