LCPQ/qp2
9
1
Fork 0
mirror of https://github.com/QuantumPackage/qp2.git synced 2025-01-11 20:48:10 +01:00
Code Releases Activity

parameters are not variables (openmp data-sharing)

Browse Source
This commit is contained in:
Kevin Gasperich 2020-02-10 15:29:58 -06:00
parent c4154c10ea
commit 4ded39470b
1 changed files with 2 additions and 2 deletions
Show Stats Download Patch File Download Diff File Expand all files Collapse all files

4
src/hartree_fock/fock_matrix_hf_complex.irp.f
View File

@ -33,7 +33,7 @@
!$OMP n_elements,ao_two_e_integral_alpha_tmp,ao_two_e_integral_beta_tmp, &
!$OMP c0,key1)&
!$OMP SHARED(ao_num,SCF_density_matrix_ao_alpha_complex, &
!$OMP SCF_density_matrix_ao_beta_complex,i_sign, &
!$OMP SCF_density_matrix_ao_beta_complex, &
!$OMP ao_integrals_map, ao_two_e_integral_alpha_complex, ao_two_e_integral_beta_complex)
call get_cache_map_n_elements_max(ao_integrals_map,n_elements_max)
@ -116,7 +116,7 @@
!$OMP n_elements,ao_two_e_integral_alpha_tmp,ao_two_e_integral_beta_tmp, &
!$OMP c0,key1)&
!$OMP SHARED(ao_num,SCF_density_matrix_ao_alpha_complex, &
!$OMP SCF_density_matrix_ao_beta_complex,i_sign, &
!$OMP SCF_density_matrix_ao_beta_complex, &
!$OMP ao_integrals_map_2, ao_two_e_integral_alpha_complex, ao_two_e_integral_beta_complex)
call get_cache_map_n_elements_max(ao_integrals_map_2,n_elements_max)