2010
DOI: 10.1063/1.3359708
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Phonon transport in atomic chains coupled by thermal contacts: The role of buffer layer

Abstract: In this work, ballistic phonon transport in atomic chain nanostructures is investigated by atomic nonequilibrium Green's functions and embedded atom method. Bond length and strength modification in atomic chain ͑low-dimensional structure͒ was taken into consideration by using bond-order-length-strength correlation premise. We especially focus on the contact interface effects on phonon transmission and thermal conductance. It is found that the contact interfaces between an atomic chain and contact reservoir, i.… Show more

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Cited by 10 publications
(10 citation statements)
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“…At an average temperature = 320 K we find that TH,ph ≅ 0.22 TH,el at EL = 1 0 . However, according to the microscopic details of the junction, in particular to the shape of the electrodes, a decrease of TH,ph by about an order of magnitude with respect to the case of an ideal geometry is expected 19 . Therefore, we can assume a minimum contribution of phonons to heat transport of TH,ph ≅ 0.02 TH,el .…”
Section: Phonon Contribution To Thermal Conductancementioning
confidence: 99%
See 1 more Smart Citation
“…At an average temperature = 320 K we find that TH,ph ≅ 0.22 TH,el at EL = 1 0 . However, according to the microscopic details of the junction, in particular to the shape of the electrodes, a decrease of TH,ph by about an order of magnitude with respect to the case of an ideal geometry is expected 19 . Therefore, we can assume a minimum contribution of phonons to heat transport of TH,ph ≅ 0.02 TH,el .…”
Section: Phonon Contribution To Thermal Conductancementioning
confidence: 99%
“…Marked deviations from WF law can occur when electrons are physically confined in 1D systems, in which the Fermi-liquid state is replaced by a Tomonaga-Luttinger liquid state 19 . Owing to 1D confinement of electrons, spin-charge separation occurs, enabling scattering mechanisms to affect charge and heat transport independently.…”
Section: Introductionmentioning
confidence: 99%
“…Therefore, the strategies of developing high ZT device are improving the electronic TE efficiency and reducing the lattice thermal conductivity [14]. Currently, most of the efforts are put in to reduce the lattice thermal conductivity by investigation the phonon transport, which can be found in our previous works [11][12][13]. However, more attentions needs to be paid on the electron transport, as the electronic TE efficiency limits the performance of TE device significantly [14].…”
Section: Introductionmentioning
confidence: 99%
“…The AGF method has also been used to study thermal transport within graphene nanoribbons 13 and in atomic chains. 14 The accuracy of the AGF method can be further increased by deriving the harmonic interatomic force constants (required for the AGF method) from DFT. Such a first-principles approach has been used to study thermal transport in superlattices, 15 across metal-graphene interfaces, 16 and in molecular junctions.…”
mentioning
confidence: 99%