Electronic Ground State and Excited State Properties of complex oxidic Structures (A04)

本文将用从头算方法研究复杂氧化物异质结构中的磁邻近效应和金属衬底上氧化物薄膜的电子性质。在邻近效应的研究中，研究了非磁性氧化物的电子和磁性由于磁性组分的邻近而发生的变化。金属基底上氧化膜的研究将扩展到准晶膜。此外，还将研究缺陷和吸附原子对复合氧化物电子结构的影响。

The magnetic proximity effect in complex oxidic heterostructures and the electronic properties of thin oxide films on metal substrates will be investigated by means of ab initio methods. The changes in the electronic and magnetic properties of the non-magnetic oxide due to the neighbourhood of the magnetic component are investigated in the studies of the proximity effect. The investigations of oxidic films on metal substrates will be extended to quasicrystalline films. Furthermore, the influence of defects and adatoms on the electronic structure of complex oxides will be investigated.