pyscfad.pbc.dft.numint.NumInt.block_loop#

NumInt.block_loop(cell, grids, nao=None, deriv=0, kpt=array([0., 0., 0.]), kpts_band=None, max_memory=2000, non0tab=None, blksize=None)[source]#: Define this macro to loop over grids by blocks.