Crystal Creator

OneAngstrom

Updated: February 27, 2024


Latest versions

4.1.1 for SAMSON 2023 R1

4.1.1 for SAMSON 2023 R1

4.1.1 for SAMSON 2023 R1

2546
361
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Crystal Creator

OneAngstrom

Updated: February 27, 2024


Latest versions

4.1.1 for SAMSON 2023 R1

4.1.1 for SAMSON 2023 R1

4.1.1 for SAMSON 2023 R1

2546
361
Generate crystal models in a few clicks. Describe unit cells, import CIF files, model defects and impurities. Cut crystals.

This extension makes it possible to generate crystal models in a few clicks.

Create crystal models from scratch

The contained app lets you create crystal models from scratch:

WriteCrystal

Cut crystals

The associated property model makes it possible to cut the crystal according to Miller indices and expose the important crystal planes:

CutCrystal

Import crystal models

Finally, this extension contains an importer to read CIF files.

Once a unit cell is written or imported, it can be repeated in the directions of the lattice vectors to create a complete crystal.

Each repetition is not a mere copy but is generated again so that defects and impurities are modeled:

OpenCrystal

Documentation

Please refer to the "Generating crystal models" tutorial for more information.

References

This extension was originally created by Francois Rousse as part of his research at NANO-D, Inria.

Crystal Creator is an extension for SAMSON,
the integrative platform for molecular design.

To use Crystal Creator:

1. Create your free account and choose a molecular design plan
2. Download and install SAMSON on your computer
3. Come back to this page to add the extension to your account


When you restart SAMSON, the extension will be automatically installed
and will be usable directly from within SAMSON.