Re-evaluating how charge transfer modifies the conformation of adsorbed molecules† †Electronic supplementary information (ESI) available. See DOI: 10.1039/c8nr02237b

@article{Blowey2018ReevaluatingHC,
  title={Re-evaluating how charge transfer modifies the conformation of adsorbed molecules† †Electronic supplementary information (ESI) available. See DOI: 10.1039/c8nr02237b},
  author={P. J. Blowey and S. Velari and L. A. Rochford and D. A. Duncan and D. Warr and T. Lee and A. De Vita and G. Costantini and D. P. Woodruff},
  journal={Nanoscale},
  year={2018},
  volume={10},
  pages={14984 - 14992}
}
  • P. J. Blowey, S. Velari, +6 authors D. P. Woodruff
  • Published 2018
  • Materials Science, Medicine
  • Nanoscale
    • A combined quantitative experimental and theoretical structure determination shows TCNQ is not bent on Ag(111) as expected from conventional wisdom. 
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    12 Citations
    Background Citations
    1
    Methods Citations
    1
    12 Citations
    Citation Type

    Citation Type

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    Theoretical investigation of metalated and unmetalated pyrphyrins immobilized on Ag(111) surface
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    Binding and Electronic Level Alignment of π-Conjugated Systems on Metals.
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    A Comparative Computational Study of the Adsorption of TCNQ and F4-TCNQ on the Coinage Metal Surfaces
    The structure of 2D charge transfer salts formed by TCNQ/alkali metal coadsorption on Ag(111)
    Corrugated graphene exposes the limits of a widely used ab initio van der Waals DFT functional
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    Surface structural phase transition induced by the formation of metal-organic networks on the Si(111)--In surface.
    • 1
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    Energy-level alignment at strongly coupled organic-metal interfaces.
    • 6
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    Characterization of growth and structure of TCNQ phases on Ag(111)
    • 1
    • PDF
    Charge Transfer into Organic Thin Films: A Deeper Insight through Machine‐Learning‐Assisted Structure Search
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    References

    SHOWING 1-10 OF 57 REFERENCES
    Impact of bidirectional charge transfer and molecular distortions on the electronic structure of a metal-organic interface.
    • 165
    • PDF
    Structure and energetics of azobenzene on Ag(111): benchmarking semiempirical dispersion correction approaches.
    • 181
    • PDF
    Strongly reshaped organic-metal interfaces: tetracyanoethylene on Cu(100).
    • 50
    • PDF
    Assembly of 2D ionic layers by reaction of alkali halides with the organic electrophile 7,7,8,8-tetracyano-p-quinodimethane (TCNQ).
    • 61
    • PDF
    Adsorption of small aromatic molecules on the (111) surfaces of noble metals: A density functional theory study with semiempirical corrections for dispersion effects.
    • 189
    • PDF
    Ordered arrays of metal-organic magnets at surfaces.
    • S. Barja, D. Stradi, +7 authors R. Miranda
    • Materials Science, Medicine
    • Journal of physics. Condensed matter : an Institute of Physics journal
    • 2013
    • 9
    Simulating the organic‐molecule/metal interface TCNQ/Au(111)
    • 23
    Understanding the self-assembly of TCNQ on Cu(111): a combined study based on scanning tunnelling microscopy experiments and density functional theory simulations
    • 10
    • PDF
    Stereoselectivity and electrostatics in charge-transfer Mn- and Cs-TCNQ₄ networks on Ag(100).
    • 73
    • PDF
    Strong electronic perturbation of the Cu{111} surface by 7,7′,8,8′-tetracyanoquinonedimethane
    • 26