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Merge branch 'casscf_good' into features_casscf

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eginer 2019-10-22 19:01:44 +02:00
commit c518296711
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11
src/bitmask/core_inact_act_virt.irp.f
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@ -129,6 +129,15 @@ BEGIN_PROVIDER [integer, dim_list_inact_orb]
dim_list_inact_orb = max(n_inact_orb,1)
END_PROVIDER
BEGIN_PROVIDER [integer, dim_list_core_inact_orb]
implicit none
BEGIN_DOC
! dimensions for the allocation of list_core.
! it is at least 1
END_DOC
dim_list_core_inact_orb = max(n_core_inact_orb,1)
END_PROVIDER
BEGIN_PROVIDER [integer, dim_list_act_orb]
implicit none
BEGIN_DOC
@ -328,7 +337,7 @@ END_PROVIDER
BEGIN_PROVIDER [ integer, list_core_inact , (n_core_inact_orb) ]
BEGIN_PROVIDER [ integer, list_core_inact , (dim_list_core_inact_orb) ]
&BEGIN_PROVIDER [ integer, list_core_inact_reverse, (mo_num) ]
implicit none
BEGIN_DOC