过渡金属
电子结构
金属K边
原子轨道
金属L边
基态
X射线光电子能谱
光谱学
X射线吸收光谱法
吸收光谱法
材料科学
光电发射光谱学
金属
分子
电子组态
化学
结晶学
原子物理学
计算化学
核磁共振
物理
电子
光学
离子
生物化学
有机化学
量子力学
催化作用
冶金
作者
Thomas Kröll,R. Kraus,R. Schönfelder,V. Yu. Aristov,О. В. Молодцова,Patrick Hoffmann,M. Knupfer
摘要
Transition metal phthalocyanines (MPc's) are an interesting class of material, and their magnetic and electronic properties are determined by the orbital occupation of the transition metal 3d orbitals incorporated in the molecules center. Thus, the ground state configuration of the transition metal center is very important for a complete understanding of these materials. We present experimental data taken using x-ray absorption and x-ray photoemission spectroscopy together with a theoretical interpretation of MPc series with M=Zn, Cu, Ni, Co, Fe, and Mn. The combination of these methods allows us to narrow down possible dominating ground state configurations and shed a brighter light on the electronic structure of these complexes.
科研通智能强力驱动
Strongly Powered by AbleSci AI