From e1523c492941cd8a9d290743956b6b2a20f589bf Mon Sep 17 00:00:00 2001 From: Anthony Scemama Date: Fri, 31 Jan 2025 11:40:49 +0100 Subject: [PATCH] Removed irrelevent dependency on cholesky --- src/mo_two_e_ints/map_integrals.irp.f | 4 ++-- src/tools/print_energy.irp.f | 5 ++--- 2 files changed, 4 insertions(+), 5 deletions(-) diff --git a/src/mo_two_e_ints/map_integrals.irp.f b/src/mo_two_e_ints/map_integrals.irp.f index 6040842e..5b233899 100644 --- a/src/mo_two_e_ints/map_integrals.irp.f +++ b/src/mo_two_e_ints/map_integrals.irp.f @@ -155,7 +155,7 @@ double precision function get_two_e_integral(i,j,k,l,map) type(map_type), intent(inout) :: map real(integral_kind) :: tmp - PROVIDE mo_two_e_integrals_in_map mo_integrals_cache do_mo_cholesky mo_cholesky_double cholesky_mo_transp_sp cholesky_mo_transp + PROVIDE mo_two_e_integrals_in_map mo_integrals_cache do_mo_cholesky if (use_banned_excitation) then if (banned_excitation(i,k)) then @@ -570,7 +570,7 @@ subroutine get_mo_two_e_integrals_exch_ii(k,l,sze,out_val,map) type(map_type), intent(inout) :: map integer :: i double precision, external :: get_two_e_integral - PROVIDE mo_two_e_integrals_in_map mo_cholesky_double cholesky_mo_transp cholesky_mo_transp_sp + PROVIDE mo_two_e_integrals_in_map mo_cholesky_double if ( (mo_integrals_cache_min>1).or.(mo_integrals_cache_max