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CrystalExplorer

swMATH ID: 42338
Software Authors: Wolff SK, Grimwood DJ, McKinnon JJ, Turner MJ, Jayatilaka D, Spackman MA
Description: CrystalExplorer is a standard tool for investigating intermolecular interactions and packing in crystalline materials using Hirshfeld surface analysis. CrystalExplorer also includes powerful tools to generate surfaces based on ab initio quantum mechanical property densities. By mapping these properties and other distance- and curvature-related metrics on Hirshfeld surfaces, CrystalExplorer provides unique insights into the in-crystal environment. CrystalExplorer can also readily display and quantify voids in crystal structures.
Homepage: https://wiki.crystalexplorer.net/quick-start
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Referenced in: 1 Publication

Referenced by 1 Author

1 Elahi, Ahsan

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