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Pinned

  1. Organisms Organisms Public

    The Otago Research Genetic Algorithm for Nanoclusters, Including Structural Methods and Similarity (Organisms) program is a genetic algorithm designed to globally optimise nanoclusters (also known …

    Python 6 3

  2. NISP NISP Public

    The Nanocluster interpolation Scheme Program (NISP) is designed to perform an interpolation scheme that gives idea of the types of icosahedral, decahedral, and octahedral clusters that may exist at…

    Python

  3. Adsorber Adsorber Public

    Adsorber is designed to adsorb atoms and molecules in various way to a nanocluster or surface.

    Python 3

  4. LatticeFinder LatticeFinder Public

    LatticeFinder is a program designed to find the lattice constant for any bulk system. Currently developed for 3D materials, but maybe further developed for 2D materials.

    Jupyter Notebook

  5. GeoProps GeoProps Public

    This program is designed to provide information about the geometric properties of individual nanoclusters, including the radial distribution function and the number of neighbours surrounding each a…

    Python

  6. Geoffrey-R-Weal-PhD-Thesis Geoffrey-R-Weal-PhD-Thesis Public

    This repository contains the thesis and digital supplementary information from Geoffrey R. Weal's PhD thesis.

    Python