Search for dissertations about: "analytic bond order potentials"

Found 1 swedish dissertation containing the words analytic bond order potentials.

  2. 1. Atomistic modeling of interfaces in WC-Co cemented carbides

    Author : Martin Petisme; Chalmers tekniska högskola; []
    Keywords : NATURVETENSKAP; NATURAL SCIENCES; analytic bond order potentials; weing; WC-Co; grain boundary sliding; grain boundaries; density functional theory; molecular dynamics; interfaces; cemented carbides;

    Abstract : Grain and phase boundaries are crucial in understanding the properties of real materials. In this thesis, interfaces in WC–Co cemented carbide are modeled atomistically using density functional theory (DFT) and analytic interatomic potentials. READ MORE