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Increased number of fragments

This commit is contained in:
Anthony Scemama 2018-06-06 10:47:51 +02:00
parent 9f127c40a7
commit c8ee603667

View File

@ -5,7 +5,7 @@ BEGIN_PROVIDER [ integer, fragment_count ]
BEGIN_DOC
! Number of fragments for the deterministic part
END_DOC
fragment_count = (elec_alpha_num-n_core_orb)**2
fragment_count = (elec_alpha_num-n_core_orb)*mo_tot_num
END_PROVIDER