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    Effective Doping of Square/Octagon-Phase Arsenene by Adsorption of Organic Molecules

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    Type
    Article
    Authors
    Zhao, Ning cc
    Schwingenschlögl, Udo cc
    KAUST Department
    Computational Physics and Materials Science (CPMS)
    Material Science and Engineering Program
    Physical Science and Engineering (PSE) Division
    Date
    2021-03-27
    Online Publication Date
    2021-03-27
    Print Publication Date
    2021-05
    Embargo End Date
    2022-03-27
    Submitted Date
    2020-11-23
    Permanent link to this record
    http://hdl.handle.net/10754/668290
    
    Metadata
    Show full item record
    Abstract
    Adsorption of organic molecules can be a better choice than traditional chemical doping to achieve effective doping of 2D materials. The adsorption of organic molecules on square/octagon-phase (S/O-phase) arsenene is investigated and promoted the possibility of developing p–n junctions. In particular, it is found that adsorption of F4-TCNQ or TCNE molecules leads to effective p-doping. Adsorption of DMPD or TTF molecules leads to less effective n-doping. Interestingly, in the case of TTF adsorption strain engineering can be used to greatly improve the material properties. Therefore, both effective n- and p-doping of S/O-phase arsenene can be realized.
    Citation
    Zhao, N., & Schwingenschlögl, U. (2021). Effective Doping of Square/Octagon-Phase Arsenene by Adsorption of Organic Molecules. Advanced Theory and Simulations, 2000300. doi:10.1002/adts.202000300
    Sponsors
    The research reported in this publication was supported by funding from King Abdullah University of Science and Technology (KAUST).
    Publisher
    Wiley
    Journal
    Advanced Theory and Simulations
    DOI
    10.1002/adts.202000300
    Additional Links
    https://onlinelibrary.wiley.com/doi/10.1002/adts.202000300
    ae974a485f413a2113503eed53cd6c53
    10.1002/adts.202000300
    Scopus Count
    Collections
    Articles; Physical Science and Engineering (PSE) Division; Material Science and Engineering Program; Computational Physics and Materials Science (CPMS)

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