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In doped semiconductors and metals, the thermopower decreases with increasing carrier concentration, in agreement with the Pisarenko relation. Here, we demonstrate a new strain engineering approach to increase the thermopower of [001] Si/Ge…

Materials Science · Physics 2021-02-04 Vitaly. S. Proshchenko , Manoj Settipalli , Artem K. Pimachev , Sanghamitra Neogi

We show by first-principles calculations that p-doped graphane is a conventional superconductor with a critical temperature (Tc) above the boiling point of liquid nitrogen. The unique strength of the chemical bonds between carbon atoms and…

Materials Science · Physics 2018-09-12 G. Savini , A. C. Ferrari , F. Giustino

Using the semiclassical quantum Boltzmann theory and employing the Dirac model with twist angle-dependent Fermi velocity we obtain results for the electrical resistivity, the electronic thermal resistivity, the Seebeck coefficient, and the…

Mesoscale and Nanoscale Physics · Physics 2020-01-22 Mohammad Zarenia , Indra Yudishtira , Shaffique Adam , Giovanni Vignale

Ab-initio calculations have been performed to study the geometry and electronic structure of boron (B) and nitrogen (N) doped graphene sheet. The effect of doping has been investigated by varying the concentrations of dopants from 2 % (one…

Mesoscale and Nanoscale Physics · Physics 2012-09-25 Pooja Rani , V. K. Jindal

We use first-principles electronic structure methods to calculate the electronic thermoelectric properties (i.e. due to electronic transport only) of single-crystalline bulk $n$-type silicon-germanium alloys vs Ge composition, temperature,…

Materials Science · Physics 2025-02-03 F. Murphy-Armando

Local variations in the Seebeck coefficient in low-dimensional materials-based nanostructures and devices play a major role in their thermoelectric performance. Unfortunately, currently most thermoelectric measurements probe the aggregate…

Mesoscale and Nanoscale Physics · Physics 2020-08-25 Achim Harzheim , Charalambos Evangeli , Oleg V. Kolosov , Pascal Gehring

Organic materials have attracted recent interest as thermoelectric (TE) converters due to their low cost and ease of fabrication. We examine the effects of disorder on the TE properties of semiconducting polymers based on the Gaussian…

Materials Science · Physics 2019-03-15 Meenakshi Upadhyaya , Connor J. Boyle , Dhandapani Venkataraman , Zlatan Aksamija

Using a semi-classical approach and input from experiments on the conductivity of graphene, we determine the electronic density dependence of the electronic transport coefficients -- conductivity, thermal conductivity and thermopower -- of…

Mesoscale and Nanoscale Physics · Physics 2009-11-13 N. M. R. Peres , J. M. B. Lopes dos Santos , T. Stauber

We study the electronic contribution to the main thermoelectric properties of a molecular junction consisting of a single quantum dot coupled to graphene external leads. The system electrical conductivity (G), Seebeck coefficient ($S$), and…

Mesoscale and Nanoscale Physics · Physics 2017-10-25 S. T. Rodriguez , I. Grosu , M. Crisan , I. Tifrea

In the pursuit of developing routes to enhance magnetic Kitaev interactions in {\alpha}-RuCl3, as well as probing doping effects, we investigate the electronic properties of {\alpha}-RuCl3 in proximity to graphene. We study…

Strongly Correlated Electrons · Physics 2019-12-11 Sananda Biswas , Ying Li , Stephen M. Winter , Johannes Knolle , Roser Valenti

A strained graphene monolayer is shown to operate as a highly efficient quantum heat engine delivering maximum power. The efficiency and power of the proposed device exceeds that of recent proposals. The reason for these excellent…

Mesoscale and Nanoscale Physics · Physics 2017-09-15 Arjun Mani , Colin Benjamin

Monolayer graphene shows Seebeck coefficient several times and gas-flow-induced voltage twenty times higher than that of bulk graphite. Here we find that the Seebeck coefficient of multilayer graphene increases monotonically with increasing…

Mesoscale and Nanoscale Physics · Physics 2015-06-04 Xuemei Li , Jun Yin , Jianxin Zhou , Qin Wang , Wanlin Guo

In this article, we employ the transfer matrix method (TMM) to analytically explore the impact of uniaxial strain on electron scattering in graphene under locally periodic and super-periodic electrostatic potential. Our study reveals that…

Mesoscale and Nanoscale Physics · Physics 2025-03-25 Sudhanshu Shekhar , Bhabani Prasad Mandal , Anirban Dutta

We have studied the graphene/gold interface by means of density functional theory (DFT) and scanning tunneling spectroscopy (STS). Weak interaction between graphene and the underlying gold surface leaves unperturbed Dirac cones in the…

Materials Science · Physics 2015-06-03 J. Slawinska , I. Wlasny , P. Dabrowski , Z. Klusek , I. Zasada

The electrons in graphene for energies close to the Dirac point have been found to form strongly interacting fluid. Taking this fact into account we have extended previous work on the transport properties of graphene by taking into account…

High Energy Physics - Theory · Physics 2018-03-14 Marek Rogatko , Karol. I. Wysokinski

We present a simple theory of thermoelectric transport in bilayer graphene and report our results for the electrical resistivity, the thermal resistivity, the Seebeck coefficient, and the Wiedemann-Franz ratio as functions of doping density…

Mesoscale and Nanoscale Physics · Physics 2019-05-01 Mohammad Zarenia , Giovanni Vignale , Thomas Benjamin Smith , Alessandro Principi

The atomic variations of electronic wavefunctions at the surface and electron scattering near a defect have been detected unprecedentedly by tracing thermoelectric voltages given a temperature bias [Cho et al., Nature Mater. 12, 913…

Mesoscale and Nanoscale Physics · Physics 2014-04-02 Eui-Sup Lee , Sanghee Cho , Ho-Ki Lyeo , Yong-Hyun Kim

Bipolar carrier transport is often a limiting factor in the thermoelectric efficiency of narrow bandgap materials at high temperatures due to the reduction in the Seebeck coefficient and the introduction of an additional term to the thermal…

Materials Science · Physics 2019-03-27 Samuel Foster , Neophytos Neophytou

We theoretically study the thermoelectric transport properties of strained HgTe in the topological insulator phase. We developed a model for the system using a Dirac Hamiltonian including the effect of strain induced by the interface…

Mesoscale and Nanoscale Physics · Physics 2022-01-26 Francisco J. Peña , Oscar Negrete , Ning Ma , Patricio Vargas , Mario Reis , Leandro R. F. Lima

For carbon-based materials, in contrast to metal surfaces, the relationship between strain and reactivity is not yet established, even though there are literature reports on strained graphene. Knowledge of such relationships would be…

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