Potential of B/Al-Doped Silicene Electrodes in Na/K-Ion Batteries

Jiajie Zhu; Appala Gandi; Udo Schwingenschlögl

doi:10.1002/adts.201800017

Potential of B/Al-Doped Silicene Electrodes in Na/K-Ion Batteries

Jiajie Zhu, Appala Gandi, Udo Schwingenschlögl

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Abstract

Metal-ion batteries are key for energy storage in both portable electronics and large-scale applications. As the ion capacity of the widely used graphite electrodes is limited, 2D materials, in particular silicene, are considered for possible replacement. Here, the effects of B/Al doping on the ion capacity of silicene are studied and it is demonstrated that complex charge transfer leads to ultra-high Na capacity. Low Na/K diffusion barriers open potential for fast charge and discharge.

Original language	English (US)
Pages (from-to)	1800017
Journal	Advanced Theory and Simulations
Volume	1
Issue number	7
DOIs	https://doi.org/10.1002/adts.201800017
State	Published - May 8 2018

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KAUST Repository Item: Exported on 2020-10-01
Acknowledgements: King Abdullah University of Science and Technology

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10.1002/adts.201800017

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abstract = "Metal-ion batteries are key for energy storage in both portable electronics and large-scale applications. As the ion capacity of the widely used graphite electrodes is limited, 2D materials, in particular silicene, are considered for possible replacement. Here, the effects of B/Al doping on the ion capacity of silicene are studied and it is demonstrated that complex charge transfer leads to ultra-high Na capacity. Low Na/K diffusion barriers open potential for fast charge and discharge.",

author = "Jiajie Zhu and Appala Gandi and Udo Schwingenschl{\"o}gl",

note = "KAUST Repository Item: Exported on 2020-10-01 Acknowledgements: King Abdullah University of Science and Technology",

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AU - Zhu, Jiajie

AU - Gandi, Appala

AU - Schwingenschlögl, Udo

N1 - KAUST Repository Item: Exported on 2020-10-01 Acknowledgements: King Abdullah University of Science and Technology

PY - 2018/5/8

Y1 - 2018/5/8

N2 - Metal-ion batteries are key for energy storage in both portable electronics and large-scale applications. As the ion capacity of the widely used graphite electrodes is limited, 2D materials, in particular silicene, are considered for possible replacement. Here, the effects of B/Al doping on the ion capacity of silicene are studied and it is demonstrated that complex charge transfer leads to ultra-high Na capacity. Low Na/K diffusion barriers open potential for fast charge and discharge.

AB - Metal-ion batteries are key for energy storage in both portable electronics and large-scale applications. As the ion capacity of the widely used graphite electrodes is limited, 2D materials, in particular silicene, are considered for possible replacement. Here, the effects of B/Al doping on the ion capacity of silicene are studied and it is demonstrated that complex charge transfer leads to ultra-high Na capacity. Low Na/K diffusion barriers open potential for fast charge and discharge.

UR - http://hdl.handle.net/10754/630399

UR - https://onlinelibrary.wiley.com/doi/pdf/10.1002/adts.201800017

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SP - 1800017

JO - Advanced Theory and Simulations

JF - Advanced Theory and Simulations

IS - 7

ER -

Potential of B/Al-Doped Silicene Electrodes in Na/K-Ion Batteries

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