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ML FF NDIM SCALAPACK

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ML_FF_NDIM_SCALAPACK = [integer]
Default: ML_FF_NDIM_SCALAPACK = 2 

Description: This flag sets the dimension of the ScaLAPACK grids used in the machine learning force field method.


As default the arrays are parallelized over rows and columns (hence value 2). In majority of cases the users should not change this tag.

Related Tags and Sections

ML_FF_LMLFF

Examples that use this tag