From 6584a0c707207d288ae290c01c13a8694a91f108 Mon Sep 17 00:00:00 2001 From: Barthelemy Pradines LCT Date: Mon, 27 May 2019 15:17:10 +0200 Subject: [PATCH] added missing dependency inao_two_e_erf_ints/two_e_integrals_erf.irp.f --- src/ao_two_e_erf_ints/two_e_integrals_erf.irp.f | 2 ++ 1 file changed, 2 insertions(+) diff --git a/src/ao_two_e_erf_ints/two_e_integrals_erf.irp.f b/src/ao_two_e_erf_ints/two_e_integrals_erf.irp.f index 4433690f..97debfab 100644 --- a/src/ao_two_e_erf_ints/two_e_integrals_erf.irp.f +++ b/src/ao_two_e_erf_ints/two_e_integrals_erf.irp.f @@ -15,6 +15,8 @@ double precision function ao_two_e_integral_erf(i,j,k,l) double precision :: Q_new(0:max_dim,3),Q_center(3),fact_q,qq integer :: iorder_p(3), iorder_q(3) double precision :: ao_two_e_integral_schwartz_accel_erf + + provide mu_erf if (ao_prim_num(i) * ao_prim_num(j) * ao_prim_num(k) * ao_prim_num(l) > 1024 ) then ao_two_e_integral_erf = ao_two_e_integral_schwartz_accel_erf(i,j,k,l)