Yet another AiiDA plugin for CRYSTAL code, mainly intended for use with the MPDS online ecosystem
Project description
aiida-crystal-dft
This is the AiiDA plugin for running the CRYSTAL code,
spin-off from the aiida-crystal17 plugin by Chris Sewell.
The plugin can be used as any other AiiDA plugin.
License
MIT © Andrey Sobolev and Evgeny Blokhin, Tilde Materials Informatics
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