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This can be done with the following commands from aiida.orm.data.array. kpoints import KpointsData kpoints KpointsData kpointsmesh 2 kpoints. B Graph generated by nesting workfunctions. A wrapper workfunction create rescaled calls serially create structure and rescale. Type in your shell or modify the functions defined in createrescale. py and then run def createrescaled element scale return rescale s0 scale and create an already rescaled structure by typing s1 createrescaled element Str Si...
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aiida tutorial - indico is a platform where users can access tutorials and resources related to the AiiDA software for computational materials science.
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