The super raman intensity induced by spin-orbit coupling effect in monolayer MoS2 and WS2 under varying pressures

IF 10 2区 材料科学 Q1 MATERIALS SCIENCE, MULTIDISCIPLINARY
Yuan Shang, Yuqiang Wu, Mengtao Sun
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Abstract

Transition metal dichalcogenides (TMDs) are regarded as an optimal material for investigating the quantum effect of Spin-orbit coupling (SOC). Although many experiments have measured the physical properties of TMDs materials, the influence of the SOC effect on these properties cannot be determined. Here, we selected monolayer MoS2 and WS2 to investigate their physical properties in both the normal and SOC systems under varying pressures. By comparing the calculated results, the SOC effect significantly influences the effective mass of electrons and holes in the material, it determines the conductive properties of the material. This effect exerts a major influence on the dielectric properties of the material, and also enhances the polarization rate. Meanwhile, we have revised the traditional formula for calculating the raman intensity of symmetric dielectric tensors. The discovery of the super raman intensity effect of TMDs materials induced by the SOC effect has been made. Furthermore, we have discovered and explained how to modulate the TMDs materials in the visible light range to transition into a plasma state at specific wavelengths under pressure, and also reveal the influence of pressure on the strength of characteristic raman modes. The findings of this study provide pioneering theoretical support for the realization of the super raman intensity effect through the quantum effect and pressure manipulation of materials into a plasma state.

不同压力下单层 MoS2 和 WS2 自旋轨道耦合效应诱导的超拉曼强度
过渡金属二掺杂物(TMDs)被认为是研究自旋轨道耦合(SOC)量子效应的最佳材料。尽管许多实验都测量了 TMDs 材料的物理性质,但却无法确定 SOC 效应对这些性质的影响。在此,我们选择了单层 MoS 和 WS,研究它们在不同压力下的正常体系和 SOC 体系中的物理性质。通过比较计算结果,SOC 效应显著影响了材料中电子和空穴的有效质量,并决定了材料的导电性能。这种效应对材料的介电性能产生了重大影响,并提高了极化率。同时,我们修正了对称介电张量的传统喇曼强度计算公式。发现了由 SOC 效应诱导的 TMDs 材料的超拉曼强度效应。此外,我们还发现并解释了如何在可见光范围内调制 TMDs 材料,使其在压力作用下过渡到特定波长的等离子体状态,并揭示了压力对特征拉曼模式强度的影响。本研究的发现为通过量子效应和压力操纵材料进入等离子状态实现超拉曼强度效应提供了开创性的理论支持。
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来源期刊
Materials Today Physics
Materials Today Physics Materials Science-General Materials Science
CiteScore
14.00
自引率
7.80%
发文量
284
审稿时长
15 days
期刊介绍: Materials Today Physics is a multi-disciplinary journal focused on the physics of materials, encompassing both the physical properties and materials synthesis. Operating at the interface of physics and materials science, this journal covers one of the largest and most dynamic fields within physical science. The forefront research in materials physics is driving advancements in new materials, uncovering new physics, and fostering novel applications at an unprecedented pace.
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