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半金属硼烷片的费米边缘及其多孔结构还原

Fermi Edge of Semimetallic Borophane Sheets and its Reduction by a Porous Structure.

作者信息

Zhang Xiaoni, Miyamoto Masashige, Yuan Mei, Tsujikawa Yuki, Yamaguchi Kazuki, Horio Masafumi, Ozawa Kenichi, Yubuta Kunio, Kondo Takahiro, Matsuda Iwao

机构信息

Institute for Solid State Physics (ISSP), The University of Tokyo, Kashiwa, Chiba 277-8581, Japan.

Institute of Pure and Applied Sciences, University of Tsukuba, Tsukuba, Ibaraki 305-8573, Japan.

出版信息

J Phys Chem Lett. 2024 Sep 19;15(37):9349-9355. doi: 10.1021/acs.jpclett.4c01869. Epub 2024 Sep 6.

Abstract

Theoretically predicted materials are often synthesized in low yields, and unexpected relationships are often encountered between the target materials and byproducts. Recently, two-dimensional boron materials proposed on the basis of model simulations and first principles calculations and possessing abundant atomic structures have attracted considerable interest. Borophane or the hydrogen boride (HB) sheet has been predicted to be the Dirac nodal semimetal when it has a boron network of nonsymmorphic symmetry. Upgrading the standard method, we fabricated freestanding HB sheets possessing either an apparent Fermi edge, reduced spectral weight, or a Fermi-level energy gap, as confirmed by using microbeam photoemission spectroscopy. The gapless electronic structures were correlated with terminal B-H bonds at the sheet edges, indicating the electronic modification of the porous structure as directly microscopically observed. The gapped or insulating sheet was fabricated oxidation. This research provides methods for regulating the structural morphology and electronic states of HB sheets during synthesis.

摘要

理论预测的材料通常以低产率合成,并且目标材料与副产物之间经常会出现意想不到的关系。最近,基于模型模拟和第一性原理计算提出的具有丰富原子结构的二维硼材料引起了相当大的关注。硼烷或硼化氢(HB)片材在具有非对称对称的硼网络时被预测为狄拉克节点半金属。通过改进标准方法,我们制备了具有明显费米边缘、降低的光谱权重或费米能级能隙的独立HB片材,这通过微束光电子能谱得到了证实。无隙电子结构与片材边缘的末端B-H键相关,这表明在显微镜下直接观察到的多孔结构的电子修饰。通过氧化制备了有能隙或绝缘的片材。这项研究提供了在合成过程中调节HB片材结构形态和电子态的方法。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/f2d5/11418824/247fa5b31db2/jz4c01869_0002.jpg

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