Thermal Interface Conductance Between Aluminum and Silicon by Molecular Dynamics Simulations

The thermal interface conductance between Al and Si was simulated by a non-equilibrium molecular dynamics method. In the simulations, the coupling between electrons and phonons in Al are considered by using a stochastic force. The results show the size dependence of the interface thermal conductance...

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Main Authors: Yang, Nuo, Luo, Tengfei, Esfarjani, Keivan, Henry, Asegun, Tian, Zhiting, Shiomi, Junichiro, Chalopin, Yann, Li, Baowen, Chen, Gang
Other Authors: Massachusetts Institute of Technology. Department of Mechanical Engineering
Format: Article
Language:en_US
Published: American Scientific Publishers 2015
Online Access:http://hdl.handle.net/1721.1/97396
https://orcid.org/0000-0002-3968-8530
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author Yang, Nuo
Luo, Tengfei
Esfarjani, Keivan
Henry, Asegun
Tian, Zhiting
Shiomi, Junichiro
Chalopin, Yann
Li, Baowen
Chen, Gang
author2 Massachusetts Institute of Technology. Department of Mechanical Engineering
author_facet Massachusetts Institute of Technology. Department of Mechanical Engineering
Yang, Nuo
Luo, Tengfei
Esfarjani, Keivan
Henry, Asegun
Tian, Zhiting
Shiomi, Junichiro
Chalopin, Yann
Li, Baowen
Chen, Gang
author_sort Yang, Nuo
collection MIT
description The thermal interface conductance between Al and Si was simulated by a non-equilibrium molecular dynamics method. In the simulations, the coupling between electrons and phonons in Al are considered by using a stochastic force. The results show the size dependence of the interface thermal conductance and the effect of electron–phonon coupling on the interface thermal conductance. To understand the mechanism of interface resistance, the vibration power spectra are calculated. We find that the atomic level disorder near the interface is an important aspect of interfacial phonon transport, which leads to a modification of the phonon states near the interface. There, the vibrational spectrum near the interface greatly differs from the bulk. This change in the vibrational spectrum affects the results predicted by AMM and DMM theories and indicates new physics is involved with phonon transport across interfaces.
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spelling mit-1721.1/973962022-10-01T11:13:54Z Thermal Interface Conductance Between Aluminum and Silicon by Molecular Dynamics Simulations Yang, Nuo Luo, Tengfei Esfarjani, Keivan Henry, Asegun Tian, Zhiting Shiomi, Junichiro Chalopin, Yann Li, Baowen Chen, Gang Massachusetts Institute of Technology. Department of Mechanical Engineering Yang, Nuo Tian, Zhiting Chen, Gang The thermal interface conductance between Al and Si was simulated by a non-equilibrium molecular dynamics method. In the simulations, the coupling between electrons and phonons in Al are considered by using a stochastic force. The results show the size dependence of the interface thermal conductance and the effect of electron–phonon coupling on the interface thermal conductance. To understand the mechanism of interface resistance, the vibration power spectra are calculated. We find that the atomic level disorder near the interface is an important aspect of interfacial phonon transport, which leads to a modification of the phonon states near the interface. There, the vibrational spectrum near the interface greatly differs from the bulk. This change in the vibrational spectrum affects the results predicted by AMM and DMM theories and indicates new physics is involved with phonon transport across interfaces. United States. Dept. of Energy. Office of Science (Solid-State Solar-Thermal Energy Conversion Center Award DE-SC0001299/DE-FG02-09ER46577) National Natural Science Foundation (China) (11334007) National Natural Science Foundation (China) (11204216) 2015-06-12T15:47:21Z 2015-06-12T15:47:21Z 2015-02 Article http://purl.org/eprint/type/JournalArticle 15461955 15461963 http://hdl.handle.net/1721.1/97396 Yang, Nuo, Tengfei Luo, Keivan Esfarjani, Asegun Henry, Zhiting Tian, Junichiro Shiomi, Yann Chalopin, Baowen Li, and Gang Chen. “Thermal Interface Conductance Between Aluminum and Silicon by Molecular Dynamics Simulations.” Journal of Computational and Theoretical Nanoscience 12, no. 2 (February 1, 2015): 168–74. https://orcid.org/0000-0002-3968-8530 en_US http://dx.doi.org/10.1166/jctn.2015.3710 Journal of Computational and Theoretical Nanoscience Creative Commons Attribution-Noncommercial-Share Alike http://creativecommons.org/licenses/by-nc-sa/4.0/ application/pdf American Scientific Publishers arXiv
spellingShingle Yang, Nuo
Luo, Tengfei
Esfarjani, Keivan
Henry, Asegun
Tian, Zhiting
Shiomi, Junichiro
Chalopin, Yann
Li, Baowen
Chen, Gang
Thermal Interface Conductance Between Aluminum and Silicon by Molecular Dynamics Simulations
title Thermal Interface Conductance Between Aluminum and Silicon by Molecular Dynamics Simulations
title_full Thermal Interface Conductance Between Aluminum and Silicon by Molecular Dynamics Simulations
title_fullStr Thermal Interface Conductance Between Aluminum and Silicon by Molecular Dynamics Simulations
title_full_unstemmed Thermal Interface Conductance Between Aluminum and Silicon by Molecular Dynamics Simulations
title_short Thermal Interface Conductance Between Aluminum and Silicon by Molecular Dynamics Simulations
title_sort thermal interface conductance between aluminum and silicon by molecular dynamics simulations
url http://hdl.handle.net/1721.1/97396
https://orcid.org/0000-0002-3968-8530
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