I am trying to do a NMR J coupling calculation. I followed the requirements listed in the help, i.e. P1 symmetry, OTFG, ZORA.
But I get the following error for the J-coupling calculations:
wave_allocate_wv: error opening page file
Current trace stack:
wave_allocate_wv
magres_jcoupling_spin_total
magres_jcoupling_spin
magres_run
castep
Any ideas on how to solve this?
Thanks, Andreas
But I get the following error for the J-coupling calculations:
wave_allocate_wv: error opening page file
Current trace stack:
wave_allocate_wv
magres_jcoupling_spin_total
magres_jcoupling_spin
magres_run
castep
Any ideas on how to solve this?
Thanks, Andreas