Quantum Spin Transport in Carbon Chains

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• 作者：Zeila Zanolli ; Giovanni Onida ; J.-C. Charlier
• 刊名：ACS Nano
• 出版年：2010
• 出版时间：September 28, 2010
• 年：2010
• 卷：4
• 期：9
• 页码：5174-5180
• 全文大小：453K
• 年卷期：0
• ISSN：1936-086X

文摘

First-principles and non-equilibrium Green’s function approaches are used to predict spin-polarized electronic transport in monatomic carbon chains covalently connected to graphene nanoribbons, as recently synthetized experimentally (Jin, C.; et al. Phys. Rev. Lett. 2009, 102, 205501−205504). Quantum electron conductances exhibit narrow resonant states resulting from the simultaneous presence of open conductance channels in the contact region and on the chain atoms. Odd-numbered chains, which acquire metallic or semiconducting character depending on the nature of the edge at the graphene contact, always display a net spin polarization. The combination of electrical and magnetic properties of chains and contacts results in nanodevices with intriguing spintronic properties such as the coexistence of magnetic and semiconducting behaviors.