From 4ad77651276305fdfbed5648a57bb9965dab636b Mon Sep 17 00:00:00 2001 From: Anthony Scemama Date: Wed, 12 Jul 2023 18:56:13 +0200 Subject: [PATCH] Minor changes --- src/ccsd/ccsd_space_orb_sub_chol.irp.f | 3 +-- 1 file changed, 1 insertion(+), 2 deletions(-) diff --git a/src/ccsd/ccsd_space_orb_sub_chol.irp.f b/src/ccsd/ccsd_space_orb_sub_chol.irp.f index fc5da8c0..0ba46e56 100644 --- a/src/ccsd/ccsd_space_orb_sub_chol.irp.f +++ b/src/ccsd/ccsd_space_orb_sub_chol.irp.f @@ -457,8 +457,7 @@ subroutine compute_r2_space_chol(nO,nV,t1,t2,tau,H_oo,H_vv,H_vo,r2,max_r2) integer :: u,v,i,j,beta,gam,a,b double precision :: max_r2_local - ! Residual - !r2 = 0d0 + call set_multiple_levels_omp(.False.) !$omp parallel & !$omp shared(nO,nV,r2,cc_space_v_oovv) &