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Porous nanowires (NWs) with tunable thermal conductance are examined as a candidate for thermoelectric (TE) devices with high efficiency (ZT). Thermal conductance of porous Si and Ge NWs is calculated using the complete phonon dispersion…

Mesoscale and Nanoscale Physics · Physics 2015-05-20 Abhijeet Paul , Gerhard Klimeck

Vapour-deposited organic glasses are currently in use in many optoelectronic devices. Their operation temperature is limited by the glass transition temperature of the organic layers and thermal management strategies become increasingly…

Electrical conductance is quantized in units of $\sigma_{\rm Q}=2e^2/h$ in ballistic one-dimensional conductors. Similarly, thermal conductance at temperature $T$ is expected to be limited by the quantum of thermal conductance of one mode,…

Mesoscale and Nanoscale Physics · Physics 2009-11-11 M. Meschke , W. Guichard , J. P. Pekola

We present a comprehensive first-principles investigation of optical, transport, and thermoelectric properties of pure and doped hexagonal Si$_x$Ge$_{1-x}$ alloys based on density-functional theory calculations, the Boltzmann transport…

Materials Science · Physics 2022-05-26 Pedro Borlido , Friedhelm Bechstedt , Silvana Botti , Claudia Rödl

While there are several methods, e.g., anharmonic lattice dynamics and normal mode decomposition, to compute the modal lattice vibrational information in perfect crystals, the modal information of vibrations, e.g., vibrational relaxation…

Disordered Systems and Neural Networks · Physics 2021-07-02 Yanguang Zhou

The investigation of thermal properties of recently emerged two-dimensional (2D) materials is a necessary step towards fulfilling their potential applications in nano-electronics devices. In this study, the thermal conductivity of novel…

Materials Science · Physics 2019-06-26 Armin Taheri , Carlos Da Silva , Cristina H. Amon

This work summarizes recent progress on the thermal transport properties of three-dimensional (3D) nanostructures, with an emphasis on experimental results. Depending on the applications, different 3D nanostructures can be prepared or…

Applied Physics · Physics 2019-09-16 Haifei Zhan , Yihan Nie , Yongnan Chen , John M. Bell , Yuantong Gu

The effect on the vibrational and thermal properties of gradually interconnected nanoinclusions embedded in an amorphous silicon matrix is studied using MD simulations. The nanoinclusion arrangement ranges from an aligned sphere array to an…

Mesoscale and Nanoscale Physics · Physics 2021-05-10 Paul Desmarchelier , Alice Carré , Konstantinos Termentzidis , Anne Tanguy

Thermal transport through nanosystems is central to numerous processes in chemistry, material sciences, electrical and mechanical engineering, with classical molecular dynamics as the key simulation tool. Here we focus on thermal junctions…

Mesoscale and Nanoscale Physics · Physics 2020-08-31 Na'im Kalantar , Bijay Kumar Agarwalla , Dvira Segal

The thermal conductivity of YbRh2Si2 has been measured down to very low temperatures under field in the basal plane. An additional channel for heat transport appears below 30 mK, both in the antiferromagnetic and paramagnetic states,…

Strongly Correlated Electrons · Physics 2015-07-23 M. Taupin , G. Knebel , T. D. Matsuda , G. Lapertot , Y. Machida , K. Izawa , J. -P. Brison , J. Flouquet

Tailoring thermal properties with nanostructured materials can be of vital importance for many applications. Generally classical phonon size effects are employed to reduce the thermal conductivity, where strong phonon scattering by…

Applied Physics · Physics 2019-10-14 Yue Xiao , Qiyu Chen , Dengke Ma , Nuo Yang , Qing Hao

We study the thermal conductivity within the E$_{1g}$ and E$_{2u}$ models for superconductivity in UPt$_3$ and compare the theoretical results for electronic heat transport with recently measured results reported by Lussier, Ellman and…

Condensed Matter · Physics 2009-10-28 M. J. Graf , S. -K. Yip , J. A. Sauls

Thermodynamics and transport properties of a dissipative particle in a tight-binding model are studied through specific heat and optical conductivity. A weak coupling theory is constituted to study the crossover behavior between the…

Statistical Mechanics · Physics 2009-10-30 Takeo Kato , Masatoshi Imada

Materials with low thermal conductivity usually have complex crystal structures. Herein we experimentally find that a simple crystal structure material AgTlI2 (I4/mcm) owns an extremely low thermal conductivity of 0.25 W/mK at room…

Nanoporous materials are a promising platform for thermoelectrics in that they offer high thermal conductivity tunability while preserving good electrical properties, a crucial requirement for high- effciency thermal energy conversion.…

Materials Science · Physics 2017-09-20 Giuseppe Romano , Jeffrey C. Grossman

The role of interfacial nonidealities and disorder on thermal transport across interfaces is traditionally assumed to add resistance to heat transfer, decreasing the thermal boundary conductance (TBC).$^1$ However, recent computational…

Approach-to-equilibrium molecular dynamics simulations have been used to study thermal transport in nanocrystalline graphene sheets. Nanostructured graphene has been created using an iterative process for grain growth from initial seeds…

Materials Science · Physics 2015-11-26 Konstanze R. Hahn , Claudio Melis , Luciano Colombo

We compute atomistically the heat conductance for ultra-thin pristine silicon nanowires (SiNWs) with diameters ranging from 1 to 5 nm. The room temperature thermal conductance is found to be highly anisotropic: wires oriented along the…

Materials Science · Physics 2009-01-09 Troels Markussen , Antti-Pekka Jauho , Mads Brandbyge

Thermal phonon transport in square- and triangular-lattice Si phononic crystal (PnC) nanostructures with a period of 300 nm was investigated by measuring the thermal conductivity using micrometer-scale time-domain thermoreflectance. The…

Mesoscale and Nanoscale Physics · Physics 2015-05-22 Junki Nakagawa , Yuta Kage , Takuma Hori , Junichiro Shiomi , Masahiro Nomura

Observations of the hot gas surrounding Sgr A* and a few other nearby galactic nuclei imply electron and proton mean free paths comparable to the gas capture radius: hot accretion likely proceeds under weakly-collisional conditions in these…

Astrophysics · Physics 2007-05-23 Kristen Menou