Comparative study of electronic, thermoelectric, and transport properties in germanene and carbon nanotubes

IF 3.9 3区 材料科学 Q2 MATERIALS SCIENCE, MULTIDISCIPLINARY Materials Science and Engineering B-advanced Functional Solid-state Materials Pub Date : 2024-11-16 DOI:10.1016/j.mseb.2024.117826
Somayeh Behzad
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Abstract

This study investigates the electronic, thermoelectric, and transport properties of Germanene nanotubes (GeNTs) using a tight-binding calculations and explores their potential advantages over carbon nanotubes (CNTs) in thermoelectric applications. The effect of external electric and magnetic fields, nanotube radius, and temperature on heat capacity, electrical conductivity, power factor, and Seebeck coefficient are systematically investigated. The heat capacity C(T) of GeNTs shows a more pronounced increase with the application of external fields, especially electric field and exceeds that of CNTs. GeNTs also exhibit a lower threshold temperature for non-zero electrical conductivity attributed to their smaller energy gap, which results from easier thermal excitation of charge carriers. This property becomes more pronounced as the electrical conductivity of GeNTs increases more rapidly with temperature than that of CNTs, particularly under stronger external fields. Additionally, the thermoelectric properties of GeNTs can be further enhanced under external fields. While CNTs possess higher Seebeck coefficients and Lorenz numbers, GeNTs demonstrate distinct advantages in tunable heat capacity and conductivity, making them promising candidates for efficient thermoelectric and nanoelectronic devices. These results underscore the potential of GeNTs as an effective alternative to CNTs for advanced energy conversion applications, demonstrating their promise as high-performance thermoelectric materials for energy conversion applications.

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锗和碳纳米管的电子、热电和传输特性比较研究
本研究采用紧密结合计算方法研究了格耳曼纳米管(GeNTs)的电子、热电和传输特性,并探讨了其在热电应用中相对于碳纳米管(CNTs)的潜在优势。系统研究了外部电场和磁场、纳米管半径和温度对热容量、电导率、功率因数和塞贝克系数的影响。GeNTs 的热容量 C(T) 在外加电场(尤其是电场)的作用下有更明显的增加,超过了 CNTs。GeNTs 还表现出较低的非零电导阈值温度,这归因于其较小的能隙,而能隙是电荷载流子更容易被热激发的结果。随着温度的升高,GeNT 的电导率比 CNT 的电导率上升得更快,尤其是在较强的外场条件下,这一特性变得更加明显。此外,在外加电场的作用下,GeNT 的热电特性还能进一步增强。虽然 CNTs 具有更高的塞贝克系数和洛伦兹数,但 GeNTs 在可调热容量和导电性方面具有明显优势,因此有望成为高效热电和纳米电子器件的候选材料。这些结果凸显了 GeNTs 作为先进能源转换应用中 CNTs 的有效替代品的潜力,表明它们有望成为能源转换应用中的高性能热电材料。
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来源期刊
CiteScore
5.60
自引率
2.80%
发文量
481
审稿时长
3.5 months
期刊介绍: The journal provides an international medium for the publication of theoretical and experimental studies and reviews related to the electronic, electrochemical, ionic, magnetic, optical, and biosensing properties of solid state materials in bulk, thin film and particulate forms. Papers dealing with synthesis, processing, characterization, structure, physical properties and computational aspects of nano-crystalline, crystalline, amorphous and glassy forms of ceramics, semiconductors, layered insertion compounds, low-dimensional compounds and systems, fast-ion conductors, polymers and dielectrics are viewed as suitable for publication. Articles focused on nano-structured aspects of these advanced solid-state materials will also be considered suitable.
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