• 文献标题:   A Short Review on the Magnetic Effects Occurring at Organic Ferromagnetic Interfaces Formed between Benzene-Like Molecules and Graphene with Ferromagnetic Surfaces
  • 文献类型:   Article
  • 作  者:   ATODIRESEI N, CACIUC V, LAZIC P
  • 作者关键词:   density functional theory, ab initio studie, molecular electronic, molecular spintronic, spinpolarization, magnetic exchange coupling, hybrid interface, bonding mechanism
  • 出版物名称:   ZEITSCHRIFT FUR NATURFORSCHUNG SECTION AA JOURNAL OF PHYSICAL SCIENCES
  • ISSN:   0932-0784 EI 1865-7109
  • 通讯作者地址:   Forschungszentrum Julich
  • 被引频次:   0
  • DOI:   10.5560/ZNA.2014-0026
  • 出版年:   2014

▎ 摘  要

In this article, we briefly summarize our results gained from recent density functional theory simulations aimed to investigate the interaction between organic materials containing pi-electrons (i.e., several benzene-like molecules and graphene) with ferromagnetic surfaces. We show how the strong hybridization between the p(z)-electrons that initially form the pi molecular orbitals with the magnetic d-states of the metal influences the spin polarization, the magnetic exchange coupling, and the magnetization direction at hybrid organic ferromagnetic interface. From a practical perspective, these properties play a very important role for device applications based on organic materials and magnetic surfaces.