Superconductivity and electron self-energy in tungsten-sulfur-hydride monolayer

IF 5.5 3区 材料科学 Q2 CHEMISTRY, PHYSICAL ACS Applied Energy Materials Pub Date : 2024-02-02 DOI:10.1088/2053-1583/ad2523
Jakkapat Seeyangnok, M. M. Ul Hassan, U. Pinsook, Graeme Ackland
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Abstract

Hydrogen-rich structures have recently gained attention as a candidate for room-temperature superconductors. Hydrogen has high phonon frequencies and can be an ideal component for superconductors if it also exhibits strong electronphonon coupling. In bulk materials, this has been achieved only under very high pressure. Two-dimensional (2D) hydrogen-decorated materials can also be expected to become superconductors. Recently, it was shown that a Janus MoSH monolayer can be synthesized [1], and a theoretical investigation of this MoSH monolayer claimed that Tc = 28.58K at atmospheric pressure [2]. In this work, we propose that tungsten sulfur hydride (WSH) is also a superconducting Janus monolayer. The Tc is carefully calculated with very high resolution via the Eliashberg spectral function and the electron self-energy. We find that WSH is a conventional BCS superconductor with Tc = 12.2K at ambient pressure. For practical applications, sensitive dependence on substrate is inferred. We also reported the electron self-energy of WSH, which can be compared directly with future measurements from angle-resolved photoelectron spectroscopy (ARPES).
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钨硫氢单层的超导性和电子自能
作为室温超导体的候选材料,富氢结构近来备受关注。氢具有很高的声子频率,如果它也表现出很强的电子-声子耦合,就会成为超导体的理想成分。在块体材料中,只有在非常高的压力下才能实现这一点。二维(2D)氢装饰材料也有望成为超导体。最近的研究表明,可以合成一种 Janus MoSH 单层材料[1],对这种 MoSH 单层材料的理论研究表明,在大气压力下,Tc = 28.58K[2]。在这项工作中,我们提出氢化硫化钨(WSH)也是一种超导简纳斯单层。通过埃利亚什伯格光谱函数和电子自能,我们以极高的分辨率仔细计算了 Tc。我们发现,WSH 是一种传统的 BCS 超导体,在环境压力下的 Tc = 12.2K。在实际应用中,可以推断出对衬底的敏感依赖性。我们还报告了 WSH 的电子自能,这可以直接与角度分辨光电子能谱(ARPES)的未来测量结果进行比较。
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来源期刊
ACS Applied Energy Materials
ACS Applied Energy Materials Materials Science-Materials Chemistry
CiteScore
10.30
自引率
6.20%
发文量
1368
期刊介绍: ACS Applied Energy Materials is an interdisciplinary journal publishing original research covering all aspects of materials, engineering, chemistry, physics and biology relevant to energy conversion and storage. The journal is devoted to reports of new and original experimental and theoretical research of an applied nature that integrate knowledge in the areas of materials, engineering, physics, bioscience, and chemistry into important energy applications.
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