Electronic structure and simulated STM images of non-honeycomb phosphorene allotropes

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dc.contributor.authorKaur, S.
dc.contributor.authorKumar, A.
dc.contributor.authorSrivastava, S.
dc.contributor.authorTankeshwar, K.
dc.date.accessioned2018-07-14T01:18:43Z
dc.date.accessioned2024-08-13T12:45:45Z
dc.date.available2018-07-14T01:18:43Z
dc.date.available2024-08-13T12:45:45Z
dc.date.issued2018
dc.description.abstractWe have investigated the electronic structure and simulated STM images of various non-honeycomb allotropes of phosphorene namely ? - P, ? - P, ? - P and ? - P, within combined density functional theory and Tersoff-Hamman approach. All these allotropes are found to be energetically stable and electronically semiconductingwith bandgap ranging between 0.5-1.2 eV. Simulated STM images show distinctly different features in terms of the topography. Different maximas in the distance-height profile indicates the difference in buckling of atoms in these allotropes. Distinctly different images obtained in this study may be useful to differentiate various allotropes that can serve as fingerprints to identify various allotropes during the synthesis of phosphorene. ? 2018 Author(s).en_US
dc.identifier.citationKaur, S., Kumar, A., Srivastava, S., & Tankeshwar, K. (2018). Electronic structure and simulated STM images of non-honeycomb phosphorene allotropes. Paper presented at the AIP Conference Proceedings.en_US
dc.identifier.doi10.1063/1.5028854
dc.identifier.isbn978-0-7354-1634-5
dc.identifier.issn0094243X
dc.identifier.urihttp://10.2.3.109/handle/32116/1313
dc.identifier.urlhttps://aip.scitation.org/doi/abs/10.1063/1.5028854
dc.language.isoenen_US
dc.publisherAmerican Institute of Physics Inc.en_US
dc.titleElectronic structure and simulated STM images of non-honeycomb phosphorene allotropesen_US
dc.title.journalAIP Conference Proceedings
dc.typeConference Paperen_US

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