From 192f4c6913cb0eedfd1b69c76759720253901d55 Mon Sep 17 00:00:00 2001 From: Anthony Scemama Date: Thu, 4 May 2023 17:49:41 +0200 Subject: [PATCH] Fixed one-two electron --- devel/trexio/export_trexio_routines.irp.f | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/devel/trexio/export_trexio_routines.irp.f b/devel/trexio/export_trexio_routines.irp.f index c983d45..8635eb7 100644 --- a/devel/trexio/export_trexio_routines.irp.f +++ b/devel/trexio/export_trexio_routines.irp.f @@ -384,7 +384,7 @@ subroutine export_trexio ! One-e MO integrals ! ------------------ - if (export_mo_two_e_ints) then + if (export_mo_one_e_ints) then print *, 'MO one-e integrals' rc = trexio_write_mo_1e_int_kinetic(f,mo_kinetic_integrals)