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Tags: Aluminium

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  1. Ab initio Molecular Dynamics of Aluminium for force matching potential fitting

    18 Apr 2018 | Datasets | Contributor(s): Ka-Ming Tam

    ab initio Molecular Dynamics of Aluminium for force matching potential fit. Snapshots of Aluminium atom from ab initio Molecular Dynamics (Car-Parrinello). Positions, Velocities, and Forces...

    https://cimmhub.laepscor.org/resources/414.html

  2. Data for the paper "Identifying Melting Points of Metals from Classical Molecular Dynamics with Unsupervised Machine Learning Methods"

    19 Mar 2018 | Datasets | Contributor(s): Nicholas Walker, Ka-Ming Tam, Brian Novak, Mark Jarrell

    Molecular Dynamics Simulations Data for 108 Al atoms. Data used for extracting melting temperature by Machine Learning.

    https://cimmhub.laepscor.org/resources/406.html