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Role of inelastic electron–phonon scattering in electron transport through ultra-scaled amorphous phase change material nanostructures

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Abstract

The electron transport through ultra-scaled amorphous phase change material (PCM) GeTe is investigated by using ab initio molecular dynamics, density functional theory, and non-equilibrium Green’s function, and the inelastic electron–phonon scattering is accounted for by using the Born approximation. It is shown that, in ultra-scaled PCM device with 6 nm channel length, \(<\)4 % of the energy carried by the incident electrons from the source is transferred to the atomic lattice before reaching the drain, indicating that the electron transport is largely elastic. Our simulation results show that the inelastic electron–phonon scattering, which plays an important role to excite trapped electrons in bulk PCM devices, exerts very limited influence on the current density value and the shape of current–voltage curve of ultra-scaled PCM devices. The analysis reveals that the Poole–Frenkel law and the Ohm’s law, which are the governing physical mechanisms of the bulk PCM devices, cease to be valid in the ultra-scaled PCM devices.

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Acknowledgments

This work was supported by U.S. National Science Foundation (NSF) under Grant Award 1006182. We acknowledge the Pacific Northwest National Laboratory (PNNL) for providing computational resources on the PNNL Chinook supercomputers. This work used the Extreme Science and Engineering Discovery Environment (XSEDE), which is supported by National Science Foundation Grant number OCI-1053575. This work was facilitated through the use of advanced computational, storage, and networking infrastructure provided by the Hyak supercomputer system, supported in part by the University of Washington’s eScience Institute. We acknowledge J. Akola and R.O. Jones (for discussion about AIMD simulations).

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  1. Department of Electrical Engineering, University of Washington, Seattle, WA, 98195, USA

    Jie Liu, Xu Xu & M. P. Anantram

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  1. Jie Liu
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  2. Xu Xu
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  3. M. P. Anantram
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Correspondence to Jie Liu.

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Liu, J., Xu, X. & Anantram, M.P. Role of inelastic electron–phonon scattering in electron transport through ultra-scaled amorphous phase change material nanostructures. J Comput Electron 13, 620–626 (2014). https://doi.org/10.1007/s10825-014-0579-7

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  • DOI: https://doi.org/10.1007/s10825-014-0579-7

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