Yet another AiiDA plugin for CRYSTAL code, mainly intended for use with the cloud infrastructures (currently, MPDS)
Project description
aiida-crystal-dft
This is an AiiDA plugin for running the CRYSTAL code, spin-off from the aiida-crystal17 plugin by Chris Sewell.
Installation
As of now, the development version can be installed:
>> git clone aiida-crystal-dft
>> pip install -e aiida-crystal-dft
Usage
The plugin can be used as any other AiiDA plugin.
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aiida-crystal-dft-0.4.tar.gz
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