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Xizmatlar

Stephan Irle

5 ta ish

Oak Ridge National Laboratory

AkademScholarda batafsil koʻrsatkichlar

  1. DFTB+, a software package for efficient approximate density functional theory based atomistic simulations

    B. Hourahine, Bálint Aradi, Volker Blüm +36

    MaqolaOchiq kirish202015 iqtibos
    ABI

  2. Recent developments in the general atomic and molecular electronic structure system

    Giuseppe M. J. Barca, Colleen Bertoni, Laura Carrington +39

    MaqolaOchiq kirish202010 iqtibos
    ABI

  3. Growth of Linear Carbon Chains inside Thin Double-Wall Carbon Nanotubes

    Changhui Zhao, Ryo Kitaura, H. Hara +2

    Maqola20116 iqtibos
    ABI

  4. Effect of surface functional groups on MXene conductivity

    Rabi Khanal, Stephan Irle

    Maqola20235 iqtibos
    ABI

  5. Reactive Molecular Dynamics Simulation of Fullerene Combustion Synthesis: ReaxFF vs DFTB Potentials

    Hu‐Jun Qian, Adri C. T. van Duin, Keiji Morokuma +1

    Maqola20114 iqtibos
    ABI