VoroTop: Voronoi Cell Topology Visualization and Analysis Toolkit
This provides a tool for researchers in materials science to analyze atomic structures that were previously difficult to study, though it is incremental as it builds on existing Voronoi methods.
The paper introduces VoroTop, an open-source toolkit that uses Voronoi topology to analyze local structure in atomic systems, enabling automated analysis of high-temperature systems and complex structures like grain boundaries.
This paper introduces a new open-source software program called VoroTop, which uses Voronoi topology to analyze local structure in atomic systems. Strengths of this approach include its abilities to analyze high-temperature systems and to characterize complex structure such as grain boundaries. This approach enables the automated analysis of systems and mechanisms previously not possible.