[ase-users] [Jacapo] A "set_" version of the function get_ucgrid( )

Sharon Chou cnorahs at stanford.edu
Mon Mar 14 22:56:32 CET 2011


Is there a function that does the equivalent of "set_ucgrid( )" ? Or 
some way to set the size of the unit cell grid?

The closest I found was set_fftgrid( ), but changing the FFT grid size 
(soft or hard) doesn't seem to change the unit cell grid size...

Thank you for your help!



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