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  1. Article

    Open Access

    Quasi-band structure of quantum-confined nanocrystals

    We discuss the electronic properties of quantum-confined nanocrystals. In particular, we show how, starting from the discrete molecular states of small nanocrystals, an approximate band structure (quasi-band s...

    Marius Buerkle, Mickaël Lozac’h, Davide Mariotti, Vladimir Švrček in Scientific Reports (2023)

  2. Article

    Open Access

    Multi-scale electronics transport properties in non-ideal CVD graphene sheet

    In this work, we benchmark non-idealities and variations in the two-dimensional graphene sheet. We have simulated more than two hundred graphene-based devices structure. We have simulated distorted graphene sh...

    Bhupesh Bishnoi, Marius Buerkle, Hisao Nakamura in Scientific Reports (2022)

  3. Article

    Author Correction: Gate controlling of quantum interference and direct observation of anti-resonances in single molecule charge transport

    An amendment to this paper has been published and can be accessed via a link at the top of the paper.

    Yueqi Li, Marius Buerkle, Guangfeng Li, Ali Rostamian, Hui Wang in Nature Materials (2020)

  4. No Access

    Article

    Gate controlling of quantum interference and direct observation of anti-resonances in single molecule charge transport

    Quantum interference can profoundly affect charge transport in single molecules, but experiments can usually measure only the conductance at the Fermi energy. Because, in general, the most pronounced features ...

    Yueqi Li, Marius Buerkle, Guangfeng Li, Ali Rostamian, Hui Wang in Nature Materials (2019)

  5. Article

    Open Access

    Thermal conductance of Teflon and Polyethylene: Insight from an atomistic, single-molecule level

    The thermal transport properties of teflon (polytetrafluoroethylene) and its polyethylene counterparts are, while highly desirable and widely used, only superficially understood. Here, we aim therefore to prov...

    Marius Buerkle, Yoshihiro Asai in Scientific Reports (2017)