利用软 X 射线发射光谱显微镜研究 MgB2C2 的各向异性电子结构。

Yuki Hada, Masami Terauchi, Tomoya Saito, Yohei K Sato, Masaaki Baba, Masatoshi Takeda
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引用次数: 0

摘要

利用软 X 射线发射光谱电子显微镜研究了 MgB2C2 的各向异性电子结构。通过检查 C K 发射图谱选择了 MgB2C2 片段。获得的 C 和 B K 发射光谱以及 Mg L 发射光谱揭示了反映价轨道混合的常见和独特结构。据报道,这种材料具有二维 B-C 蜂窝层,因此还研究了这些发射光谱的取向依赖性。实验数据与理论计算的材料价带部分状态密度进行了比较。C K 发射曲线显示出明显的方向依赖性,而 B K 发射则显示出最小的依赖性。这种差异源于价带中 C-2pz 和 B-2pz 成分的能量分布不同。镁的 L 发射强度非常小,这可能是由于电荷从镁原子转移到了 B-N 层。镁的 L 发射曲线显示了一个与 C-K 和 B-K 结构有关的峰值。在价带的正上方观察到了一个意想不到的强度,它也显示了取向依赖性,这可能是由于与 Mg:B:C = 1:2:2 的理想组成存在微小偏差。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Anisotropic electronic structure study of MgB2C2 using soft X-ray emission 0spectroscopy microscopes.

The anisotropic electronic structure of MgB2C2 was studied using soft X-ray emission spectroscopy electron microscopes. MgB2C2 fragments were selected by examining C K-emission profiles. C and B K-emission and Mg L-emission spectra were obtained, revealing common and distinct structures that reflect the mixing of valence orbitals. Since the material is reported to have two-dimensional B-C honeycomb layers, the orientational dependence of these emission spectra was also examined. Experimental data were compared with theoretically calculated partial density of states of the valence bands of the material. The C K-emission profile showed an apparent orientational dependence, while the B K-emission exhibited minimal dependence. This difference originated from the different energy distributions of C-2pz and B-2pz components in the valence bands. The Mg L-emission intensity was very small, likely due to charge transfer from Mg atoms to B-N layers. The Mg L-emission profile showed a peak related to structures in C-K and B-K. An unexpected intensity was observed just above the valence bands, which also showed orientational dependence, possibly due to a small deviation from the ideal composition of Mg:B:C = 1:2:2.

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