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Yet another AiiDA plugin for CRYSTAL code, mainly intended for use with the MPDS online ecosystem

Project description

aiida-crystal-dft

DOI

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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aiida_crystal_dft-0.9.4.tar.gz (571.4 kB view details)

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