9
1
mirror of https://github.com/QuantumPackage/qp2.git synced 2024-10-06 16:15:57 +02:00
qp2/plugins/local/tc_int/deb_tc_int_cuda.irp.f

56 lines
1.1 KiB
Fortran
Raw Normal View History

2024-08-01 10:05:47 +02:00
! ---
program write_tc_int_cuda
implicit none
print *, ' j2e_type = ', j2e_type
print *, ' j1e_type = ', j1e_type
print *, ' env_type = ', env_type
my_grid_becke = .True.
PROVIDE tc_grid1_a tc_grid1_r
my_n_pt_r_grid = tc_grid1_r
my_n_pt_a_grid = tc_grid1_a
touch my_grid_becke my_n_pt_r_grid my_n_pt_a_grid
my_extra_grid_becke = .True.
PROVIDE tc_grid2_a tc_grid2_r
my_n_pt_r_extra_grid = tc_grid2_r
my_n_pt_a_extra_grid = tc_grid2_a
touch my_extra_grid_becke my_n_pt_r_extra_grid my_n_pt_a_extra_grid
call write_int(6, my_n_pt_r_grid, 'radial external grid over')
call write_int(6, my_n_pt_a_grid, 'angular external grid over')
call write_int(6, my_n_pt_r_extra_grid, 'radial internal grid over')
call write_int(6, my_n_pt_a_extra_grid, 'angular internal grid over')
call main()
end
! ---
subroutine main()
implicit none
2024-08-08 23:41:03 +02:00
!call deb_int_2e_ao_gpu()
2024-08-10 18:13:23 +02:00
2024-08-08 23:41:03 +02:00
!call deb_no_2e_gpu_tmp()
2024-08-10 18:13:23 +02:00
!call deb_no_2e_gpu()
2024-08-13 10:57:44 +02:00
!call deb_no_1e_gpu_tmp()
2024-08-10 18:13:23 +02:00
!call deb_no_1e_gpu()
2024-08-01 10:05:47 +02:00
2024-08-13 10:57:44 +02:00
!call deb_no_0e_gpu()
call deb_no_gpu()
2024-08-01 10:05:47 +02:00
return
end
! ---